Cas no 834885-70-0 (Cyclopentanecarbonitrile, 2-butyl-1-hydroxy-, (1R,2R)-)
834885-70-0 structure
Product Name:Cyclopentanecarbonitrile, 2-butyl-1-hydroxy-, (1R,2R)-
CAS No:834885-70-0
MF:C10H17NO
MW:167.248082876205
CID:670703
PubChem ID:71415300
Update Time:2025-04-19
Cyclopentanecarbonitrile, 2-butyl-1-hydroxy-, (1R,2R)- Chemical and Physical Properties
Names and Identifiers
-
- Cyclopentanecarbonitrile, 2-butyl-1-hydroxy-, (1R,2R)-
- (1R,2R)-2-butyl-1-hydroxycyclopentane-1-carbonitrile
- DTXSID40834720
- 834885-70-0
-
- Inchi： 1S/C10H17NO/c1-2-3-5-9-6-4-7-10(9,12)8-11/h9,12H,2-7H2,1H3/t9-,10+/m1/s1
- InChI Key： BPGMMOKNYWTRSX-ZJUUUORDSA-N
- SMILES： O[C@]1(C#N)CCC[C@H]1CCCC
Computed Properties
- Exact Mass: 167.131014166g/mol
- Monoisotopic Mass: 167.131014166g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 193
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.3
- Topological Polar Surface Area: 44?2
Cyclopentanecarbonitrile, 2-butyl-1-hydroxy-, (1R,2R)- Related Literature
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Goonay Yousefalizadeh,Shideh Ahmadi,Nicholas J. Mosey,Kevin G. Stamplecoskie Nanoscale, 2021,13, 242-252
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
834885-70-0 (Cyclopentanecarbonitrile, 2-butyl-1-hydroxy-, (1R,2R)-) Related Products
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