AG001MCX

15012-36-9 | Benzoic acid, 2,3-dimethyl-, methyl ester

AG001MCX

SDS

COA

Price

$0.00

WARNING This product is not for human or veterinary use.

CAS Number	15012-36-9
Catalog Number	AG001MCX(AGN-PC-0JKJ5T)
Chemical Name	Benzoic acid, 2,3-dimethyl-, methyl ester
IUPAC Name	methyl 2,3-dimethylbenzoate
InChI	InChI=1S/C10H12O2/c1-7-5-4-6-9(8(7)2)10(11)12-3/h4-6H,1-3H3
InChI Key	RQTXEJYGOHZSIW-UHFFFAOYSA-N
MDL Number	MFCD06203773
Molecular Formula	C10H12O2
Molecular Weight	164.2011
SMILES	O=C(OC)C1=CC=CC(C)=C1C
Synonyms	METHYL 2,3-DIMETHYLBENZOATE, 15012-36-9, Benzoic acid, 2,3-dimethyl-, methyl ester, Benzoic acid, dimethyl-, methyl ester, 2,3-DIMETHYLBENZOIC ACID METHYL ESTER, RQTXEJYGOHZSIW-UHFFFAOYSA-N, MFCD06203773, xylic methyl ester, AC1L1CBB, SCHEMBL524457, RARECHEM AL BF 0481, CTK2H1322, DTXSID60164475, KS-00000RO0, ZINC2018953, CK1189, AKOS008905010, AS01241, CS-W006309, 2,3-(CH3)2-C6H3-COOCH3, AC-28520, AJ-32685, AK136365, CJ-07410, SY004803, TS-02196, AB0030638, ST2407094, TC-308416, FT-0727882, X2847, Z-3862, MFCD06203773 (97+%), I01-10068, 73412-26-7, C10H12O2, CID27000, 872-85-5,

Complexity	165
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	164.084g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	164.204g/mol
Monoisotopic Mass	164.084g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
Signal Words	warning
UN Code

Certificate of Analysis

Lot Number