Name: 1-chloro-4-(3-chloroprop-1-enyl)benzene
SMILES:
C1=CC(=CC=C1C=CCCl)ClMolecular Processing
Molecular formula
C9H8Cl2
Molecular weight
187.07
Exact mass
186.0003
XLogP
3.59
TPSA
0
H-bond donors
0
H-bond acceptors
0
Rotatable bonds
2
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
51.21
Supplementary Information
InChIKey: CLZRDHUBODXICN-UHFFFAOYSA-N
Synonyme
p-chlorocinnamyl chloride4-chlorocinnamyl chloride4-chloro-cinnamyl chlorideSCHEMBL73286CLZRDHUBODXICN-UHFFFAOYSA-NAKOS0175186041-chloro-4-(3-chloroprop-1-enyl)benzene
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