Basic information
- CAS
408-16-2- Standard SMILES
OCCCCCCCF- InChIKey
BZIZKLZGQRAKFR-UHFFFAOYSA-N- Molecular formula
- C7H15FO
- Average molar mass
- 134.19 g/mol
- Monoisotopic mass
- 134.11069326
Names & identifiers
- Preferred name
- Heptanol, 7-fluoro-
- IUPAC
- 7-fluoroheptan-1-ol
- English name
- BRN 1697749
- Molecular formula
- C7H15FO
- Molecular weight
- 134.19
Names & synonyms
408-16-2HEPTANOL, 7-FLUORO-DTXSID80193787RefChem:1086451DTXCID201162787-fluoroheptan-1-ol7-fluoro-1-heptanol7-fluoro-heptan-1-ol7-Fluoroheptanolomega-FluoroheptanolBRN 16977494-01-00-01736 (Beilstein Handbook Reference)
Show more names
1-Heptanol, 7-fluoro-
SCHEMBL1627447SCHEMBL2094653
Database identifiers
- CAS
408-16-2- PubChem CID
- 9855
- DTXSID
DTXSID80193787- Nikkaji
- J49.362G
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 48.2
Experimental & physicochemical properties
SpringerMaterials PropertiesOptical coefficient
Physicochemical properties
- Boiling point
- 98 · 98-99 °C(Press: 12 Torr)
- Density
- 0.956 · 0.9560
- refractive index
- 1.4197 · 1.4197
- pka
- 15.18 · 15.18±0.10(Predicted)
Chemistry & industry
Suppliers8 total
宁波季诺化学品有限公司0574-87314919 057487319282 · [email protected]
上海马氏化学科技有限公司19916721580 · [email protected]
南京合巨药业有限公司25-57027686 17372956142 · [email protected]
安那莱（齐河）新材料科技有限公司18600642180（微信同） 13391601435 · [email protected]
郑州汇聚化工有限公司0371-55900031 18137872243 · [email protected]
湖北中隆康盛精细化工有限公司027-027-83850178 18162590268 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418671 +86-189 4982 3763 · [email protected]
武汉裕清嘉衡药业有限公司027-83855312 17771813295 13377865312 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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