Cas no 10264-25-2 (Pentanamide, N-hexyl-)
Pentanamide, N-hexyl- structure
Product Name:Pentanamide, N-hexyl-
CAS No:10264-25-2
MF:C11H23NO
MW:185.306423425674
CID:182440
PubChem ID:82502
Update Time:2025-04-19
Pentanamide, N-hexyl- Chemical and Physical Properties
Names and Identifiers
-
- Pentanamide, N-hexyl-
- Pentanamide, N-hexyl
- N-hexylpentanamide
- N-Hexylvaleramide
- 10264-25-2
- AI3-35716-aGb
- AKOS003865743
- SCHEMBL14733619
- n-Hexylpentanamide #
- Valeramide, N-hexyl-
- HYTMILDAGQOHDF-UHFFFAOYSA-N
- SCHEMBL7695217
- DTXSID10145431
- BRN 2351740
-
- Inchi： 1S/C11H23NO/c1-3-5-7-8-10-12-11(13)9-6-4-2/h3-10H2,1-2H3,(H,12,13)
- InChI Key： HYTMILDAGQOHDF-UHFFFAOYSA-N
- SMILES： O=C(CCCC)NCCCCCC
Computed Properties
- Exact Mass: 185.17809
- Monoisotopic Mass: 185.177964
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 8
- Complexity: 123
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 29.1
- XLogP3: 3.2
Experimental Properties
- Density: 0.9315 (rough estimate)
- Boiling Point: 319.55°C (rough estimate)
- Flash Point: 158.3°C
- Refractive Index: 1.4420 (estimate)
- PSA: 29.1
- LogP: 3.71340
Pentanamide, N-hexyl- Security Information
- Safety Term：x."> Low toxicity by ingestion. When heated to decomposition it emits toxic vapors of NOx.
Pentanamide, N-hexyl- Related Literature
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
-
Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
-
Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
-
Jason Wan Lab Chip, 2020,20, 4528-4538
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