C1=CC2=C(C(=CN=C2C=C1Br)C#N)Cl
CAS: 364793-57-7
이름: 7-bromo-4-chloroquinoline-3-carbonitrile
SMILES: C1=CC2=C(C(=CN=C2C=C1Br)C#N)Cl

Molecular Processing

Molecular formula
C10H4BrClN2
Molecular weight
267.51
Exact mass
265.9246
XLogP
3.52
TPSA
36.68
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
14
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0
Molar refractivity
59.17

Supplementary Information

InChIKey: SIBDBTCUQDTNQN-UHFFFAOYSA-N
동의어
7-Bromo-4-chloroquinoline-3-carbonitrile364793-57-77-bromo-4-chloro-quinoline-3-carbonitrileMFCD092613207-Bromo-4-chloro-3-quinolinecarbonitrile3-Quinolinecarbonitrile, 7-bromo-4-chloro-SCHEMBL5256795DTXSID90634131AKOS005142018SB21091AS-36936SY258025DB-069380CS-0001101F037075
출처 보기
9개 반응에 참여