C=CC(C)(C)C(O)c1c(C)noc1-c1ccc(Br)cc1
SMILES: C=CC(C)(C)C(O)c1c(C)noc1-c1ccc(Br)cc1

Molecular Processing

Molecular formula
C16H18BrNO2
Molecular weight
336.23
Exact mass
335.0521
XLogP
4.66
TPSA
46.26
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.312
Molar refractivity
83.31

Supplementary Information

상세 정보 불러오는 중…

6개 반응에 참여→

확장 검색

부분 구조 검색→유사 구조 검색→