CC(C)(C)OC(=O)N
CAS: 4248-19-5
Name: tert-butyl carbamate
SMILES: CC(C)(C)OC(=O)N

Molecular Processing

Molecular formula
C5H11NO2
Molecular weight
117.15
Exact mass
117.079
XLogP
0.88
TPSA
52.32
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
8
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.8
Molar refractivity
30.42

Supplementary Information

InChIKey: LFKDJXLFVYVEFG-UHFFFAOYSA-N
Synonyme
tert-Butyl carbamateCarbamic acid, 1,1-dimethylethyl esterEINECS 224-209-3LFKDJXLFVYVEFG-UHFFFAOYSA-DTXSID20195265NSC 131089RefChem:894631DTXCID30117756224-209-3InChI=1/C5H11NO2/c1-5(2,3)8-4(6)7/h1-3H3,(H2,6,7)4248-19-5T-butyl carbamateCarbamic Acid tert-Butyl EsterBoc-amideMFCD000079621,1-dimethylethyl carbamateXVU23ZNR59NSC-131089Boc amineBoc-NH2carbamic acid 1,1-dimethylethyl esterN-boc amineBOC-amineCarbamic Acid tert-Butyl Ester; Carbamic Acid tert-Butyl Ester; NSC 131089; O-tert-Butyl Carbamate; Boc-ammoniatert butyl carbamateBocNH2NH2Boct-Boc-NH2tertiary-butyl carbamateH2N-BOC
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