methyl 2-amino-2-(2,6-dichlorophenyl)acetate hydrochloride

methyl 2-amino-2-(2,6-dichlorophenyl)acetate hydrochloride

CAS: 2703752-31-0

Formula: C9H10Cl3NO2

SMILES: Cl.COC(=O)C(N)C1=C(Cl)C=CC=C1Cl

IUPAC: methyl 2-amino-2-(2,6-dichlorophenyl)acetate hydrochloride

InChI: InChI=1/C9H9Cl2NO2.ClH/c1-14-9(13)8(12)7-5(10)3-2-4-6(7)11;/h2-4,8H,12H2,1H3;1H

Composition: C (39.96%), H (3.73%), Cl (39.31%), N (5.18%), O (11.83%)

Molar Mass: 270.53

Atom Count: 25

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	268.9777117
Formal Charge	0
FSP3	0.22
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	SRQJVPCKOLPUKY-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	54.74
Topological Polar Surface Area	52.32
Polarizability	21.96
Ring Count	1
Rotatable Bond Count	3

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