C=CCC1CC(NC(=O)OC(C)(C)C)CC1=O
이름: tert-butyl 3-allyl-4-oxocyclopentylcarbamate
SMILES: C=CCC1CC(NC(=O)OC(C)(C)C)CC1=O

Molecular Processing

Molecular formula
C13H21NO3
Molecular weight
239.31
Exact mass
239.1521
XLogP
2.43
TPSA
55.4
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
17
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.692
Molar refractivity
65.7

Supplementary Information

상세 정보 불러오는 중…

3개 반응에 참여