methyl 2-(4-aminophenyl)acetate

methyl 2-(4-aminophenyl)acetate

CAS: 39552-81-3

Formula: C9H11NO2

SMILES: COC(=O)CC1=CC=C(N)C=C1

IUPAC: methyl 2-(4-aminophenyl)acetate

InChI: InChI=1S/C9H11NO2/c1-12-9(11)6-7-2-4-8(10)5-3-7/h2-5H,6,10H2,1H3

Composition: C (65.44%), H (6.71%), N (8.48%), O (19.37%)

Molar Mass: 165.192

Atom Count: 23

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	165.078978598
Formal Charge	0
FSP3	0.22
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	TVIVLENJTXGRAM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	46.84
Topological Polar Surface Area	52.32
Polarizability	17.76
Ring Count	1
Rotatable Bond Count	3

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