AG000RQ2

1261269-01-5 | Ethyl 3-Amino-5-chlorobenzoate

AG000RQ2

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CAS Number	1261269-01-5
Catalog Number	AG000RQ2(AGN-PC-0A4WNR)
Chemical Name	Ethyl 3-Amino-5-chlorobenzoate
IUPAC Name	ethyl 3-amino-5-chlorobenzoate
InChI	InChI=1S/C9H10ClNO2/c1-2-13-9(12)6-3-7(10)5-8(11)4-6/h3-5H,2,11H2,1H3
InChI Key	QZZLHCKPHMTUMA-UHFFFAOYSA-N
MDL Number	MFCD17276491
Molecular Formula	C9H10ClNO2
Molecular Weight	199.6342
SMILES	CCOC(C1=CC(Cl)=CC(N)=C1)=O
Synonyms	ETHYL 3-AMINO-5-CHLOROBENZOATE, 1261269-01-5, 3-amino-5-chloroBenzoic acid ethyl ester, SCHEMBL583546, KS-000009US, 6728AJ, MFCD17276491, ZINC62350272, ETHYL3-AMINO-5-CHLOROBENZOATE, AKOS012322556, TRA0094900, AS-42861, DA-16828, SC-50481, SY012239, AJ-114118, TC-308236, FT-0754715, Benzoic acid, 3-amino-5-chloro-, ethyl ester, Z-4146, MFCD17276491 (95+%), C9H10ClNO2, 85068-28-6,

Complexity	187
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	199.04g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	199.634g/mol
Monoisotopic Mass	199.04g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	52.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P264-P270-P301+P312-P330
UN Code

Certificate of Analysis

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