C(CC#N)CCl
CAS: 628-20-6
الاسم: 4-chlorobutanenitrile
SMILES: C(CC#N)CCl

Molecular Processing

Molecular formula
C4H6ClN
Molecular weight
103.55
Exact mass
103.0189
XLogP
1.53
TPSA
23.79
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
6
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.75
Molar refractivity
25.57

Supplementary Information

InChIKey: ZFCFBWSVQWGOJJ-UHFFFAOYSA-N
مرادفات
4-Chlorobutyronitrile628-20-64-ChlorobutanenitrileButanenitrile, 4-chloro-gamma-ChlorobutyronitrileBUTYRONITRILE, 4-CHLORO-4-chloro-butyronitrileMFCD00001972.gamma.-Chlorobutyronitrile9JDK6275GPNSC-84101-Chloro-3-cyanopropaneNSC 8410; gamma-ChlorobutyronitrileNSC 8410EINECS 211-031-6BRN 1633582AI3-523254chlorobutyronitrile?-Chlorobutyronitrile4-chloro-butanenitrile3-chloro-1-cyanopropaneGamma-chloropropyl cyanideUNII-9JDK6275GP4-Chlorobutyronitrile, 97%4-02-00-00827 (Beilstein Handbook Reference)SCHEMBL435492DTXSID0060850NSC8410NSC 8410; -ChlorobutyronitrileCS-D1161
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