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tert-butyl N-[3-(hydroxymethyl)phenyl]carbamate

tert-butyl N-[3-(hydroxymethyl)phenyl]carbamate

CAS: 118684-31-4

Formula: C12H17NO3

SMILES: CC(C)(C)OC(=O)NC1=CC=CC(CO)=C1

IUPAC: tert-butyl N-[3-(hydroxymethyl)phenyl]carbamate

InChI: InChI=1S/C12H17NO3/c1-12(2,3)16-11(15)13-10-6-4-5-9(7-10)8-14/h4-7,14H,8H2,1-3H3,(H,13,15)

Composition: C (64.55%), H (7.67%), N (6.27%), O (21.50%)

Molar Mass: 223.272

Atom Count: 33

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 223.120843411
Formal Charge 0
FSP3 0.42
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey OPMWQSDBBSURGY-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 63.17
Topological Polar Surface Area 58.56
Polarizability 23.88
Ring Count 1
Rotatable Bond Count 4

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