Home Halogens methyl 3-amino-2-chloro-4-methylbenzoate

methyl 3-amino-2-chloro-4-methylbenzoate

CAS No.:
914643-08-6
Catalog Number:
AG01DUNR
Molecular Formula:
C9H10ClNO2
Molecular Weight:
199.6342
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Product Description
Catalog Number:
AG01DUNR
Chemical Name:
methyl 3-amino-2-chloro-4-methylbenzoate
CAS Number:
914643-08-6
Molecular Formula:
C9H10ClNO2
Molecular Weight:
199.6342
MDL Number:
MFCD20724937
IUPAC Name:
methyl 3-amino-2-chloro-4-methylbenzoate
InChI:
InChI=1S/C9H10ClNO2/c1-5-3-4-6(9(12)13-2)7(10)8(5)11/h3-4H,11H2,1-2H3
InChI Key:
WTKVUWVCXDIMLE-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(c(c1Cl)N)C
Properties
Complexity:
198  
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:
2  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties