| CAS Number | 6557-86-4 |
| Catalog Number | AG006RCR(AGN-PC-0NJE82) |
| Chemical Name | Cycloheptanecarbonyl chloride |
| IUPAC Name | cycloheptanecarbonyl chloride |
| InChI | InChI=1S/C8H13ClO/c9-8(10)7-5-3-1-2-4-6-7/h7H,1-6H2 |
| InChI Key | CIYPNZYEUZQIHN-UHFFFAOYSA-N |
| MDL Number | MFCD11520758 |
| Molecular Formula | C8H13ClO |
| Molecular Weight | 160.6412 |
| SMILES | C(=O)(Cl)C1CCCCCC1 |
| Synonyms | Cycloheptanecarbonyl chloride,
6557-86-4,
cycloheptanoyl chloride,
cycloheptyl carbonyl chloride,
cycloheptane carbonyl chloride,
SCHEMBL1477908,
CTK1J6416,
DTXSID30502426,
CIYPNZYEUZQIHN-UHFFFAOYSA-N,
cycloheptanecarboxylic acid chloride,
ZINC39246356,
AKOS011881791,
NE32198,
SC-73995,
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| Complexity | 114 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 160.065g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 160.641g/mol |
| Monoisotopic Mass | 160.065g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 17.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number