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(1Z)-1,2,3-Trichloro-1-propene

HCID 5370144
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Basic information

CAS
13116-57-9
Standard SMILES
Cl/C=C(\Cl)CCl
InChIKey
HIILBTHBHCLUER-IWQZZHSRSA-N
Molecular formula
C3H3Cl3
Average molar mass
145.41 g/mol
Monoisotopic mass
143.930033

Names & identifiers

Preferred name
(1Z)-1,2,3-Trichloro-1-propene
IUPAC
(Z)-1,2,3-trichloroprop-1-ene
English name
(Z)-1,2,3-Trichloro-1-propene
Molecular formula
C3H3Cl3
Molecular weight
145.41

Names & synonyms

cis-1,2,3-Trichloro-1-propene13116-57-91,2,3-Trichloropropene, (1Z)-IK4V4M8E7K(1Z)-1,2,3-Trichloro-1-propeneRefChem:1049544(Z)-1,2,3-trichloroprop-1-ene1-Propene, 1,2,3-trichloro-, (Z)-1,2,3-trichloroprop-1-ene(Z)-1,2,3-Trichloro-1-propene(1Z)-1,2,3-trichloroprop-1-eneMFCD00018931
Show more names
1-Propene, 1,2,3-trichloro-, (1Z)-
HSDB 888EINECS 202-487-7UNII-IK4V4M8E7KNSC 164001UNII-764948U3XW1,2,3-trichloro-Propene; 1,2,3-Trichloro-1-propene; 2,3-Dichloroallyl chloride; NSC 164001Propene, 1,2,3-trichloro-, (Z)-1,3-Trichloropropene

Database identifiers

CAS
13116-57-9、96-19-5
PubChem CID
5370144
DTXSID
DTXSID70880876
UNII
IK4V4M8E7K
Nikkaji
J51.038F、J636J

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
1
Heavy atoms
6
Formal charge
0
Complexity
57.1

Experimental & physicochemical properties

SpringerMaterials PropertiesOptical coefficient

Physicochemical properties

Boiling point
87 °C · 87 °C(Press: 100 Torr)
Density
1.4238 g/cm3 · 1.4238 g/cm3(Temp: 425 °C)
FDA UNII
4 V4M8E7K · IK4V4M8E7K

Related reactions

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Compound notes

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