Cas no 746573-12-6 (2-Cyclohexen-1-amine,2-methyl-, (+)-)
746573-12-6 structure
Product Name:2-Cyclohexen-1-amine,2-methyl-, (+)-
CAS No:746573-12-6
MF:C7H13N
MW:111.184821844101
CID:560862
PubChem ID:14291802
Update Time:2024-03-01
2-Cyclohexen-1-amine,2-methyl-, (+)- Chemical and Physical Properties
Names and Identifiers
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- 2-Cyclohexen-1-amine,2-methyl-, (+)-
- 2-Cyclohexen-1-amine,2-methyl-,(+)-(9CI)
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- Inchi: 1S/C7H13N/c1-6-4-2-3-5-7(6)8/h4,7H,2-3,5,8H2,1H3
- InChI Key: UOADZOTZRYGAKT-UHFFFAOYSA-N
- SMILES: C1(N)CCCC=C1C
Computed Properties
- Exact Mass: 111.104799419g/mol
- Monoisotopic Mass: 111.104799419g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 34
- Rotatable Bond Count: 8
- Complexity: 731
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 2.7
- Topological Polar Surface Area: 26?2
2-Cyclohexen-1-amine,2-methyl-, (+)- Related Literature
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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