tert-Butyl carbazate
C₅H₁₂N₂O₂·132.160 g/mol·CID 70091
IUPAC: tert-butyl N-aminocarbamate
Also known as: 870-46-2, Hydrazinecarboxylic acid, 1,1-dimethylethyl ester, (tert-Butoxycarbonyl)hydrazine, NSC-60250, DZ6ERH52CN (+14 more)
Molecular Structure
Molecular Propertiesmass · H-bonds · stereo
Molecular Weight
132.160g/mol
Exact Mass
132.089878Da
Monoisotopic Mass
132.089878Da
XLogP
0.2
Polar Surface Area
64.4Ų
Complexity
106
Formal Charge
0
H-Bond Donors
2
H-Bond Acceptors
3
Rotatable Bonds
2
Heavy Atoms
9
Stereo Centers
0
Bond Stereo
0
Drug-Likeness (Lipinski's Rule of Five)
✓ 132.2 g/mol
MW ≤ 500
✓ 0.2
LogP ≤ 5
✓ 2
H-bond donors ≤ 5
✓ 3
H-bond acceptors ≤ 10
Passes all rules — good oral bioavailability predicted
GHS Hazard Classification
Danger
Hazards
H228Flammable solidH302Harmful if swallowedH312Harmful in contact with skin
Source: PubChem GHS Classification. Always consult the SDS for handling.
Isomers8 compounds with formula C₅H₁₂N₂O₂
(2S)-2,5-diaminopentanoic acid
CID 6262 · 132.2 g/mol
(2R)-2,5-diaminopentanoic acid
CID 71082 · 132.2 g/mol
2,5-diaminopentanoic acid
CID 389 · 132.2 g/mol
(2S)-2,5-diaminopentanoate;hydron
CID 88747248 · 132.2 g/mol
3-(2-hydroxyethylamino)propanamide
CID 117919 · 132.2 g/mol
N-ethyl-N-(1-methoxyethyl)nitrous amide
CID 43774 · 132.2 g/mol
2-hydrazinyl-3-methylbutanoic acid
CID 29841 · 132.2 g/mol
5-hydroxypentanehydrazide
CID 225567 · 132.2 g/mol