AG00IAOK

603-79-2 | 2,3-Dimethylbenzoic acid

AG00IAOK

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CAS Number	603-79-2
Catalog Number	AG00IAOK(AGN-PC-0WA5MW)
Chemical Name	2,3-Dimethylbenzoic acid
EC Number	210-058-0
IUPAC Name	2,3-dimethylbenzoic acid
InChI	InChI=1S/C9H10O2/c1-6-4-3-5-8(7(6)2)9(10)11/h3-5H,1-2H3,(H,10,11)
InChI Key	RIZUCYSQUWMQLX-UHFFFAOYSA-N
MDL Number	MFCD00002479
Molecular Formula	C9H10O2
Molecular Weight	150.1745
NSC Number	407533
SMILES	C1=CC=C(C(=C1C(O)=O)C)C
UNII	7IRP8CA267
Synonyms	2,3-dimethylbenzoate, 2,3-dimethylbenzoic acid, 2,3-DIMETHYLBENZOIC ACID, 603-79-2, Hemellitic acid, Benzoic acid, 2,3-dimethyl-, 2,3-Dimethylbenzoicacid, EINECS 210-058-0, 2,3-dimethyl benzoic acid, NSC 407533, BRN 0971590, 2,3-DiMethyl-Benzoic Acid, UNII-7IRP8CA267, 7IRP8CA267, RIZUCYSQUWMQLX-UHFFFAOYSA-N, 2,3-dimethylbenzenecarboxylic acid, MFCD00002479, vic-o-Xylylic acid, methyl m-toluic acid, PubChem2549, Medetomidine Impurity 12, Benzoic acid,3-dimethyl-, DIMETHYLBENZOIC ACID, AC1L1Y4C, AC1Q2N9Y, o-Xylene-3-carboxylic Acid, NCIOpen2_003657, SCHEMBL56188, 4-09-00-01797 (Beilstein Handbook Reference), KSC222S0B, AKOS AKM00327, ACMC-1B221, CHEBI:64823, CTK1C2900, KS-00000CFU, DTXSID50209061, 2,3-Dimethylbenzoic acid, 98%, ZINC160547, CS-M0913, ANW-33487, LABOTEST-BB LT01148246, LABOTEST-BB LT03333401, NSC407533, SBB052600, AKOS000119378, AC-3248, AS01852, AS06831, LS11825, MCULE-9247864478, NSC-407533, RTR-020864, TRA0061867, AJ-15604, AK-26167, AN-13137, BR-26167, LS-37158, N580, SC-05648, SY004805, TS-03570, AB0015886, AB1007955, TL8003822, TR-020864, AM20060337, D2221, FT-0609710, ST24032264, ST50824211, MFCD00002479 (98%), M-3202, 2,3-Dimethylbenzoic acid, purum, >=97.0% (T), AN-584/43413323, I01-0293, W-105255, InChI=1/C9H10O2/c1-6-4-3-5-8(7(6)2)9(10)11/h3-5H,1-2H3,(H,10,11, xylic acid, o-Veratric acid, 2-VERATRIC ACID, Benzoic acid, dimethyl-, dimethoxybenzoic acid,2,3-, RARECHEM AL BO 0026, C9H10O2, 2,3-DIMETHOXYBENZOIC ACID, AKOS 233-29, CID11782, C9-H10-O2, A8424, 2,3-Dimethylbenzoic acid, 98% - 25G 25g, Benzoic acid, 2,3-dimethyl- (7CI,8CI,9CI), 1521-38-6, 30587-19-0,

Complexity	154
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	150.068g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	150.177g/mol
Monoisotopic Mass	150.068g/mol
Rotatable Bond Count	1
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	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number