Cas no 61755-54-2 (5-Hepten-1-amine, 6-methyl-)
5-Hepten-1-amine, 6-methyl- structure
Product Name:5-Hepten-1-amine, 6-methyl-
CAS No:61755-54-2
MF:C8H17N
MW:127.22728228569
CID:467341
PubChem ID:12046652
Update Time:2025-04-19
5-Hepten-1-amine, 6-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 5-Hepten-1-amine, 6-methyl-
- 6-methylhept-5-en-1-amine
- SCHEMBL11208898
- DTXSID80476446
- 61755-54-2
- AKOS006341837
-
- Inchi： 1S/C8H17N/c1-8(2)6-4-3-5-7-9/h6H,3-5,7,9H2,1-2H3
- InChI Key： IXUTXMRIALJDSW-UHFFFAOYSA-N
- SMILES： NCCCC/C=C(\C)/C
Computed Properties
- Exact Mass: 127.13621
- Monoisotopic Mass: 127.136099547g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 9
- Rotatable Bond Count: 4
- Complexity: 80.6
- 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
- XLogP3: 2
- Topological Polar Surface Area: 26?2
Experimental Properties
- PSA: 26.02
5-Hepten-1-amine, 6-methyl- Related Literature
-
Daniel Messmer,Stefan Salentinig,Jakob Heier Nanoscale, 2019,11, 6929-6938
-
Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
-
Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
-
Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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