Cas no 698353-42-3 (Bicyclo[2.2.1]heptane-2,5-diamine,(1S,2S,4S,5S)-)
![Bicyclo[2.2.1]heptane-2,5-diamine,(1S,2S,4S,5S)- structure](https://ossimg.kuujia.com/scimg/698500/698353-42-3x500.png)
698353-42-3 structure
Product Name:Bicyclo[2.2.1]heptane-2,5-diamine,(1S,2S,4S,5S)-
CAS No:698353-42-3
MF:C7H14N2
MW:126.199461460114
CID:500466
PubChem ID:68027800
Update Time:2025-04-19
Bicyclo[2.2.1]heptane-2,5-diamine,(1S,2S,4S,5S)- Chemical and Physical Properties
Names and Identifiers
-
- Bicyclo[2.2.1]heptane-2,5-diamine,(1S,2S,4S,5S)-
- Bicyclo[2.2.1]heptane-2,5-diamine, (1S,2S,4S,5S)- (9CI)
- SCHEMBL10076656
- (2S,5S)-Bicyclo[2.2.1]heptane-2,5-diamine
- 698353-42-3
-
- Inchi： 1S/C7H14N2/c8-6-2-4-1-5(6)3-7(4)9/h4-7H,1-3,8-9H2/t4?,5?,6-,7-/m0/s1
- InChI Key： KVMMOSKKPJEDNG-FTDRKVFOSA-N
- SMILES： N[C@H]1CC2[C@H](CC1C2)N
Computed Properties
- Exact Mass: 126.11582
- Monoisotopic Mass: 126.116
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 9
- Rotatable Bond Count: 0
- Complexity: 110
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 4
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 52A^2
- XLogP3: -0.4
Experimental Properties
- PSA: 52.04
Bicyclo[2.2.1]heptane-2,5-diamine,(1S,2S,4S,5S)- Related Literature
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
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Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
698353-42-3 (Bicyclo[2.2.1]heptane-2,5-diamine,(1S,2S,4S,5S)-) Related Products
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