AG00DM31

55150-07-7 | Methyl 5-chloro-2-(methylamino)benzoate

AG00DM31

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CAS Number	55150-07-7
Catalog Number	AG00DM31(AGN-PC-0NISDG)
Chemical Name	Methyl 5-chloro-2-(methylamino)benzoate
IUPAC Name	methyl 5-chloro-2-(methylamino)benzoate
InChI	InChI=1S/C9H10ClNO2/c1-11-8-4-3-6(10)5-7(8)9(12)13-2/h3-5,11H,1-2H3
InChI Key	ZXWPYEIFGVQZDK-UHFFFAOYSA-N
MDL Number	MFCD07439818
Molecular Formula	C9H10ClNO2
Molecular Weight	199.6342
SMILES	O=C(OC)C1=CC(Cl)=CC=C1NC
Synonyms	Methyl 5-chloro-2-(methylamino)benzoate, 55150-07-7, 5-chloro-2-methylaminobenzoic acid methyl ester, Benzoic acid, 5-chloro-2-(methylamino)-, methyl ester, SCHEMBL4358899, CTK1F7403, DTXSID80494741, ZXWPYEIFGVQZDK-UHFFFAOYSA-N, KS-00000T3I, ZINC8731281, MFCD07439818, AKOS002665761, AS06908, DS-8669, AK174196, SY033537, MFCD07439818 (95%), ACN-050195,

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	38.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4

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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