AG0033FN

99-66-1 | 2-Propylpentanoic Acid

AG0033FN

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CAS Number	99-66-1
Catalog Number	AG0033FN(AGN-PC-00DAAZ)
Chemical Name	2-Propylpentanoic Acid
EC Number	202-777-3
IUPAC Name	2-propylpentanoic acid
InChI	InChI=1S/C8H16O2/c1-3-5-7(6-4-2)8(9)10/h7H,3-6H2,1-2H3,(H,9,10)
InChI Key	NIJJYAXOARWZEE-UHFFFAOYSA-N
MDL Number	MFCD00002672
Molecular Formula	C8H16O2
Molecular Weight	144.2114
NSC Number	93819
SMILES	O=C(O)C(CCC)CCC
UNII	614OI1Z5WI
Synonyms	2 Propylpentanoic Acid, 2-Propylpentanoic Acid, Calcium Valproate, Convulsofin, Depakene, Depakine, Depakote, Dipropyl Acetate, Divalproex, Divalproex Sodium, Ergenyl, Magnesium Valproate, Propylisopropylacetic Acid, Semisodium Valproate, Sodium Valproate, Valproate, Valproate Calcium, Valproate Sodium, Valproic Acid, Valproic Acid, Sodium Salt (2:1), Vupral, VALPROIC ACID, 2-Propylpentanoic acid, 99-66-1, Dipropylacetic acid, 2-Propylvaleric acid, Depakine, Depakene, Ergenyl, Di-n-propylacetic acid, Valproate, Mylproin, Pentanoic acid, 2-propyl-, 4-Heptanecarboxylic acid, n-Dipropylacetic acid, Propylvaleric acid, Myproic Acid, Di-n-propylessigsaure, n-DPA, Dipropylacetate, Convulex, Depakin, Vupral, Acido valproico, Acide valproique, Acidum valproicum, Avugane, Baceca, Stavzor, Kyselina 2-propylvalerova, 2-n-Propyl-n-valeric acid, Acetic acid, dipropyl-, Abbott 44090, Valproinsaeure, Deproic, Savicol, Depakine chrono, Depakin chrono, Alti-Valproic, Novo-Valproic, Penta-Valproic, 2,2-di-n-propylacetic acid, Dom-Valproic, Med Valproic, Nu-Valproic, Acide valproique [INN-French], Acido valproico [INN-Spanish], Acidum valproicum [INN-Latin], 2-PROPYL-PENTANOIC ACID, Di-n-propylessigsaure [German], Valeric acid, 2-propyl-, divalproex, Valproic acid USP, PMS-Valproic Acid, Epilim, Kyselina 2-propylvalerova [Czech], Di-n-propylessigsaeure, UNII-614OI1Z5WI, MFCD00002672, NSC 93819, Delepsine, Sprinkle, Valcote, Valparin, Epilex, HSDB 3582, Depakene (TN), EINECS 202-777-3, VPA, CHEMBL109, (n-C3H7)2CHCOOH, BRN 1750447, AI3-10500, 614OI1Z5WI, CHEBI:39867, NIJJYAXOARWZEE-UHFFFAOYSA-N, NCGC00091149-01, Convulsofin, DSSTox_CID_3733, DSSTox_RID_77171, DSSTox_GSID_23733, 2-Propylpentanoic acid, 99%, Valproic acid (USP), CAS-99-66-1, Depakote (TM), SMR000499581, Valproic acid [USAN:INN:BAN], Valproic acid USP24, 2 PP (base), Valproic Acid, Sodium Salt (2:1), Valproinsaure, Novo-divalproex, Sandoz valproic, Dom-valproate, Gen-divalproex, Apo-valproic, A-44090, APO-divalproex, DOM-divalproex, Epival er, PHL-valproate, PMS-valproate, PMS-Divalproex, Erganyl; Stavzor, Dom-valproic acid, Apo-valproic syrup, PHL-valproic acid, Epiject I.V., 2-propyl-Pentanoate, Epical (TM), Epilim (Salt/Mix), Valproic acid [USAN:USP:INN:BAN], 2-PropylpentanoicAcid, Depacon (Salt/Mix), Convulex (Salt/Mix), Eurekene (Salt/Mix), G2M-777, Valparin (Salt/Mix), Novo-Valproic - ECC, Spectrum_000521, Divalproex (Salt/Mix), Dom-valproic acid syrup, Ratio-Valproic - ECC, Valdisoval (Salt/Mix), ACMC-209sdq, 2 -propylpentanoic acid, di-n-propyl acetic acid, AC1Q2ULA, S(-)-4-En-valproate, Spectrum2_000946, Spectrum3_001733, Spectrum4_000376, DOM-valproic acid E.C., Heptane-4-carboxylic acid, PHL-valproic acid E.C., PMS-valproic acid E.C., Novo-valproic soft gel cap, EC 202-777-3, AC1L1F7T, SCHEMBL2275, S-2-n-Propyl-4-pentenoate, (S)-2-propyl-4-pentanoate, KBioGR_000871, KBioGR_002277, KBioSS_001001, KBioSS_002278, KSC493G8T, MLS001076682, MLS001335927, MLS001335928, MLS002415770, BIDD:GT0858, DivK1c_000273, SPBio_000912, GTPL7009, DTXSID6023733, WLN: QVY3 & 3, CTK3J3389, KBio1_000273, KBio2_001001, KBio2_002277, KBio2_003569, KBio2_004845, KBio2_006137, KBio2_007413, KBio3_002626, KBio3_002757, KS-00000CCR, NIJJYAXOARWZEE-UHFFFAOYSA-, Valproic acid [USAN:BAN:INN], NINDS_000273, HMS2089J06, HMS2231E06, HMS3259C18, HMS3370C21, HMS3715B15, ACT05281, NSC93819, ZINC3008621, Tox21_111091, Tox21_201963, Tox21_300603, ANW-41052, BDBM50003616, LMFA01020291, NSC-93819, SBB065764, STL445581, AKOS009156895, Tox21_111091_1, Valproic Acid 1.0 mg/ml in Methanol, CCG-221127, CS-1765, DB00313, LS-2068, MCULE-7136317196, NC00584, RL06134, RTR-031980, TRA0085608, NCGC00091149-02, NCGC00091149-03, NCGC00091149-04, NCGC00091149-05, NCGC00091149-06, NCGC00091149-08, NCGC00091149-09, NCGC00162288-07, NCGC00254365-01, NCGC00259512-01, AJ-44336, AK128830, AN-24519, AS-11354, CPD000499581, HY-10585, SAM002564230, SBI-0050864.P003, AB0009719, LS-161170, TR-031980, 791-EP2306789A1, FT-0609289, P0823, 6400-EP1441224A2, 6400-EP2272537A2, 6400-EP2272827A1, 6400-EP2275420A1, 6400-EP2280008A2, 6400-EP2298764A1, 6400-EP2298765A1, 6400-EP2308867A2, 6400-EP2308870A2, 6400-EP2311494A1, 6400-EP2311840A1, 6400-EP2314585A1, 6400-EP2374790A1, A19450, C07185, D00399, AB00698315-06, I04-0211, Q-200321, Sodium valproate; 2-Propylpentanoic acid sodium salt, SR-01000075242-7, F2191-0115, Z1511532065, Valproic acid, European Pharmacopoeia (EP) Reference Standard, Valproic acid, United States Pharmacopeia (USP) Reference Standard, InChI=1/C8H16O2/c1-3-5-7(6-4-2)8(9)10/h7H,3-6H2,1-2H3,(H,9,10), Valproic acid for system suitability, European Pharmacopoeia (EP) Reference Standard, Valproic acid solution, 1.0 mg/mL in methanol, ampule of 1 mL, certified reference material, Valproic acid, Pharmaceutical Secondary Standard; Certified Reference Material, Depakote, Sodium valproate, Valproate sodium, Epival, Dipropyl Acetate, Magnesium valproate, Valdisoval, Calcium valproate, Myproate, Valproate calcium, Semisodium Valproate, 2-propylpentanoate, Depakote CP, Depakote ER, DIVALPROEX SODIUM, Valproate semisodium, divalproex disodium, PEAC, Convulex (TN), Depakote (TN), Encorate (TN), Winthrop (TN), 2-propylvaleriansyre, Depacon (TN), Stavzor (TN), Epilim (TN), Epival (TN), Depakote ER (TN), DPA (VAN), Propylisopropylacetic Acid, Sodium 2-propylpentanoate, 2 Propylpentanoic Acid, valproate (valproic acid), Sodium hydrogen divalproate, D04WPG, D0Y3KG, 2,2-Di-n-propylessigsaure, S(-)-4-En-valproic acid, C8H16O2, Valproate semisodique [French], Valproato semisodico [Spanish], Valproatum seminatricum [Latin], S-2-n-Propyl-4-pentenoic acid, (S)-2-Propyl-4-pentanoic acid, CID3121, DRG-0130, Valproic Acid, SodiumSalt (2:1), C8-H16-O2, CS-T-46266, FA(8:0), DPA, 2878A, B1251, 3-02-00-00807 (Beilstein Handbook Reference), 2-Propylpentanoic acid, 98% - 100G 100g, D014635, SR-01000075242, 2-PROPYL-4-METHYL-6-(1-METHYLBENZIMIDAZOL-2-YL)BENZIMIDAZOLE, 1069-66-5, 76584-70-8, 99-67-2,

Complexity	93.4
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	144.115g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	144.214g/mol
Monoisotopic Mass	144.115g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335-H350-H360
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code	\N

Certificate of Analysis

Lot Number