AG0073N1

42122-75-8 | Methyl 5-amino-2-chlorobenzoate

AG0073N1

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CAS Number	42122-75-8
Catalog Number	AG0073N1(AGN-PC-0LOCJG)
Chemical Name	Methyl 5-amino-2-chlorobenzoate
IUPAC Name	methyl 5-amino-2-chlorobenzoate
InChI	InChI=1S/C8H8ClNO2/c1-12-8(11)6-4-5(10)2-3-7(6)9/h2-4H,10H2,1H3
InChI Key	LBNPBOFVHYOPIB-UHFFFAOYSA-N
MDL Number	MFCD07800315
Molecular Formula	C8H8ClNO2
Molecular Weight	185.6076
SMILES	O=C(OC)C1=CC(N)=CC=C1Cl
Synonyms	methyl 5-amino-2-chlorobenzoate, 42122-75-8, Methyl-5-amino-2-chlorobenzoate, Methyl 2-chloro-5-aminobenzoate, 5-amino-2-chlorobenzoic acid methyl ester, LBNPBOFVHYOPIB-UHFFFAOYSA-N, 5-Amino-2-chloro-benzoic acid methyl ester, benzoic acid, 5-amino-2-chloro-, methyl ester, ZERO/004981, AC1NP9JK, AC1Q42FO, SCHEMBL57389, Methyl5-Amino-2-chlorobenzoate, Methyl 2-chlor-5-aminobenzoate, CTK4I5731, KS-00000BKQ, DTXSID40409457, methyl 5-amino-2-chloro-benzoate, WT069, BCP24532, Methyl 2-chloro-5-(amino)benzoate, ZINC4344261, ANW-46918, MFCD07800315, SBB013130, STK711017, AKOS000113005, MCULE-2073454381, AC-29816, AJ-50750, AK-61315, AS-18359, BR-61315, SC-67456, SY013757, 2-Chloro-5-aminobenzoic acid methyl ester, AB0024857, DB-070259, ST2407271, ST4130745, TL8003008, TX-013442, 4CH-002460, 5-Am ino-2-chloro-benzoic acid methyl ester, FT-0687117, M2812, Methyl 5-amino-2-chlorobenzoate, AldrichCPR, W6208, Benzoic acid,5-amino-2-chloro-, methyl ester, EN300-29596, MFCD07800315 (97%), 42122-75-8 methyl-5-amino-2-chlorobenzoate, S-2647, I01-8577, I14-10518, Z1100225116, C8H8ClNO2, ACN-027209, CID5200412,

Complexity	174
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	185.024g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	185.607g/mol
Monoisotopic Mass	185.024g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	52.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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