tert-butyl N-[(4-aminophenyl)methyl]carbamate

tert-butyl N-[(4-aminophenyl)methyl]carbamate

CAS: 94838-55-8

Formula: C12H18N2O2

SMILES: CC(C)(C)OC(=O)NCC1=CC=C(N)C=C1

IUPAC: tert-butyl N-[(4-aminophenyl)methyl]carbamate

InChI: InChI=1S/C12H18N2O2/c1-12(2,3)16-11(15)14-8-9-4-6-10(13)7-5-9/h4-7H,8,13H2,1-3H3,(H,14,15)

Composition: C (64.84%), H (8.16%), N (12.60%), O (14.39%)

Molar Mass: 222.288

Atom Count: 34

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	222.136827828
Formal Charge	0
FSP3	0.42
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	UXWQXBSQQHAGMG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	64.1
Topological Polar Surface Area	64.35
Polarizability	24.41
Ring Count	1
Rotatable Bond Count	4

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