Cas no 6898-80-2 (1-Propanamine, 2-methyl-N-propylidene-)
6898-80-2 structure
Product Name:1-Propanamine, 2-methyl-N-propylidene-
CAS No:6898-80-2
MF:C7H15N
MW:113.200701951981
CID:392382
PubChem ID:12345759
Update Time:2025-04-19
1-Propanamine, 2-methyl-N-propylidene- Chemical and Physical Properties
Names and Identifiers
-
- 1-Propanamine, 2-methyl-N-propylidene-
- N-(2-methylpropyl)propan-1-imine
- (1E)-N-(2-Methylpropyl)propan-1-imine
- SCHEMBL8526257
- DTXSID30492737
- 6898-80-2
- SCHEMBL16230035
-
- Inchi： 1S/C7H15N/c1-4-5-8-6-7(2)3/h5,7H,4,6H2,1-3H3/b8-5+
- InChI Key： XPDFXTPNFBDQML-VMPITWQZSA-N
- SMILES： N(=C/CC)\CC(C)C
Computed Properties
- Exact Mass: 113.120449483g/mol
- Monoisotopic Mass: 113.120449483g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 8
- Rotatable Bond Count: 3
- Complexity: 64.8
- 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: 1.6
- Topological Polar Surface Area: 12.4?2
1-Propanamine, 2-methyl-N-propylidene- Related Literature
-
Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
-
Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
-
David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
-
Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
-
Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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