tert-butyl N-{[2-(hydroxymethyl)phenyl]methyl}carbamate

tert-butyl N-{[2-(hydroxymethyl)phenyl]methyl}carbamate

CAS: 1333114-86-5

Formula: C13H19NO3

SMILES: CC(C)(C)OC(=O)NCC1=CC=CC=C1CO

IUPAC: tert-butyl N-{[2-(hydroxymethyl)phenyl]methyl}carbamate

InChI: InChI=1S/C13H19NO3/c1-13(2,3)17-12(16)14-8-10-6-4-5-7-11(10)9-15/h4-7,15H,8-9H2,1-3H3,(H,14,16)

Composition: C (65.80%), H (8.07%), N (5.90%), O (20.23%)

Molar Mass: 237.299

Atom Count: 36

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	237.136493476
Formal Charge	0
FSP3	0.46
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	DKGGBZVYBKJFBX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	66.22
Topological Polar Surface Area	58.56
Polarizability	25.73
Ring Count	1
Rotatable Bond Count	5

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