CN(C)C(=O)c1ccc(C(=O)OC(C)(C)C)c(Cl)c1
이름: tert-butyl 2-chloro-4-(dimethylcarbamoyl)benzoate
SMILES: CN(C)C(=O)c1ccc(C(=O)OC(C)(C)C)c(Cl)c1

Molecular Processing

Molecular formula
C14H18ClNO3
Molecular weight
283.75
Exact mass
283.0975
XLogP
3
TPSA
46.61
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
19
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.429
Molar refractivity
74.64

Supplementary Information

상세 정보 불러오는 중…

8개 반응에 참여