Cas no 64384-44-7 (1-Amino-2-methylcyclohexane-1-carbonitrile)
64384-44-7 structure
Product Name:1-Amino-2-methylcyclohexane-1-carbonitrile
CAS No:64384-44-7
MF:C8H14N2
MW:138.210161685944
CID:2190240
PubChem ID:16784369
Update Time:2025-04-21
1-Amino-2-methylcyclohexane-1-carbonitrile Chemical and Physical Properties
Names and Identifiers
-
- 1-Amino-2-methylcyclohexane-1-carbonitrile
- DB-291327
- SCHEMBL11446715
- 64384-44-7
- AKOS000141586
-
- Inchi： 1S/C8H14N2/c1-7-4-2-3-5-8(7,10)6-9/h7H,2-5,10H2,1H3
- InChI Key： XLANTDJWMAKCLI-UHFFFAOYSA-N
- SMILES： NC1(C#N)CCCCC1C
Computed Properties
- Exact Mass: 138.115698455Da
- Monoisotopic Mass: 138.115698455Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 167
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.1
- Topological Polar Surface Area: 49.8?2
1-Amino-2-methylcyclohexane-1-carbonitrile Related Literature
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José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
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Chandran Rajendran,Govindaswamy Satishkumar,Charlotte Lang,Eric M. Gaigneaux Catal. Sci. Technol., 2020,10, 2583-2592
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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