C(CCl)C#N
CAS: 542-76-7
Nombre: 3-chloropropanenitrile
SMILES: C(CCl)C#N

Molecular Processing

Molecular formula
C3H4ClN
Molecular weight
89.53
Exact mass
89.0032
XLogP
1.14
TPSA
23.79
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
5
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
0.667
Molar refractivity
20.95

Supplementary Information

InChIKey: GNHMRTZZNHZDDM-UHFFFAOYSA-N
Sinónimos
3-Chloropropionitrile3-Chloropropanenitrile542-76-73-ChloropropiononitrilePropanenitrile, 3-chloro-1-Chloro-2-cyanoethane3-CHLOROPROPANONITRILEPropionitrile, 3-chloro-beta-Chloropropionitrile3-ChlorpropannitrilUSAF A-8798RCRA waste number P027.beta.-ChloropropionitrileNSC 2588DTXSID4030336MFCD0000195261N7S4SZ2QNSC-2588DTXCID20103363-Chlorpropannitril [Czech]CAS-542-76-7HSDB 6042Chloropropionitrile, 3-EINECS 208-827-0RCRA waste no. P027BRN 1098454UNII-61N7S4SZ2QAI3-285263-chloro-propionitrileCH2ClCH2CN
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