2-Heptyne, 1-chloro-
Basic information
- CAS
100859-51-6- Standard SMILES
CCCCC#CCCl- InChIKey
ZFOFWJPYDYZWCS-UHFFFAOYSA-N- Molecular formula
- C7H11Cl
- Average molar mass
- 130.61 g/mol
- Monoisotopic mass
- 130.054928
Names & identifiers
- Preferred name
- 2-Heptyne, 1-chloro-
- IUPAC
- 1-chlorohept-2-yne
Names & synonyms
1-chlorohept-2-yne2-Heptyne, 1-chloro-100859-51-6NSC1471241-chloro-hept-2-yneSCHEMBL7717459SCHEMBL9953184DTXSID50301892AKOS006387332NSC-147124
Database identifiers
- CAS
100859-51-6- PubChem CID
- 287341
- DTXSID
DTXSID50301892- Nikkaji
- J483.739H
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 93.4
Experimental & physicochemical properties
SpringerMaterials PropertiesDensity
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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