AG002SED

2623-87-2 | Butanoic acid, 4-bromo-

AG002SED

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CAS Number	2623-87-2
Catalog Number	AG002SED(AGN-PC-0JLPLP)
Chemical Name	Butanoic acid, 4-bromo-
EC Number	220-083-9
IUPAC Name	4-bromobutanoic acid
InChI	InChI=1S/C4H7BrO2/c5-3-1-2-4(6)7/h1-3H2,(H,6,7)
InChI Key	GRHQDJDRGZFIPO-UHFFFAOYSA-N
MDL Number	MFCD00002817
Molecular Formula	C4H7BrO2
Molecular Weight	167.0012
NSC Number	99322
SMILES	O=C(O)CCCBr
Synonyms	4-Bromobutyric acid, 4-Bromobutanoic acid, 2623-87-2, Butanoic acid, 4-bromo-, 4-Bromo-n-butyric acid, Butyric acid, 4-bromo-, gamma-Bromobutyric acid, MFCD00002817, 4-Bromobutyric acid, 98%, RARECHEM AL BO 0176, GRHQDJDRGZFIPO-UHFFFAOYSA-N, 4-Bromobutyricacid, EINECS 220-083-9, Carboxypropyl bromide, NSC 99322, 4-bromo-butyric acid, PubChem3754, 4-bromo-butanoic acid, 4 -bromo-butyric acid, AC1L2PKD, .gamma.-Bromobutyric acid, ACMC-209gq5, AC1Q27TW, SCHEMBL26511, KSC203K6J, EMOLECULES 484735, GAMMA-BROMOBUTANOIC ACID, Jsp005163, DTXSID8052699, CTK1A3564, GRHQDJDRGZFIPO-UHFFFAOYSA-, EBD30434, KS-00000J7M, NSC99322, STR02336, ZINC1654167, ANW-25947, NSC-99322, SBB065986, STL299662, AKOS009031418, AC-6279, AS03111, CS-W016047, MCULE-5669825022, RP22967, RTR-011926, TRA0067869, VZ35372, AJ-28844, AK-41591, AN-10210, BC002560, BC219750, BP-21450, Q408, SC-02994, SY001501, 4-Bromobutyric acid; 4-Bromobutanoic acid, AB1001906, TR-011926, A5215, FT-0617878, ST24028972, MFCD00002817 (97%), K-6814, I04-1042, Q-200447, InChI=1/C4H7BrO2/c5-3-1-2-4(6)7/h1-3H2,(H,6,7), 4-BROMOBIPHENYL, C4H7BrO2, 2-BROMOHEPTANOIC ACID, C4-H7-Br-O2, CID75809, AR-1G1278, 4-Bromobutyric acid, 98% - 100G 100g, B1279, 27067-38-5,

Complexity	62.7
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	165.963g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	167.002g/mol
Monoisotopic Mass	165.963g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H314-H318-H290
Precuationary statements	P260h-P301+P330+P331-P303+P361+P353-P501a-P234-P260-P264-P301+P330+P331+P310-P303+P361+P353+P310+P363-P304+P340+P310-P305+P351+P338+P310-P390-P405-P406-P501-P280-P305+P351+P338-P310
Siginal words

Certificate of Analysis

Lot Number