methyl 2-amino-3,5-dichlorobenzoate

methyl 2-amino-3,5-dichlorobenzoate

CAS: 52727-62-5

Formula: C8H7Cl2NO2

SMILES: COC(=O)C1=C(N)C(Cl)=CC(Cl)=C1

IUPAC: methyl 2-amino-3,5-dichlorobenzoate

InChI: InChI=1S/C8H7Cl2NO2/c1-13-8(12)5-2-4(9)3-6(10)7(5)11/h2-3H,11H2,1H3

Composition: C (43.67%), H (3.21%), Cl (32.22%), N (6.37%), O (14.54%)

Molar Mass: 220.05

Atom Count: 20

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	218.9853839
Formal Charge	0
FSP3	0.12
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	FODZNORQIATQIP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	52.39
Topological Polar Surface Area	52.32
Polarizability	19.75
Ring Count	1
Rotatable Bond Count	2

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