Cas no 1402805-31-5 ((3R)-3-Aminoheptan-1-ol;hydrochloride)
1402805-31-5 structure
Product Name:(3R)-3-Aminoheptan-1-ol;hydrochloride
CAS No:1402805-31-5
MF:C7H18ClNO
MW:167.676921367645
CID:1088436
PubChem ID:73554172
Update Time:2025-04-20
(3R)-3-Aminoheptan-1-ol;hydrochloride Chemical and Physical Properties
Names and Identifiers
-
- (S)-3-Aminoheptan-1-ol hydrochloride
- (3S)-3-aminoheptan-1-ol,hydrochloride
- (3R)-3-Aminoheptan-1-ol;hydrochloride
- CGC80531
- (S)-3-Aminoheptan-1-ol HCl
- CS-0063111
- AKOS022185279
- D73273
- CS-15880
- 1402805-31-5
- starbld0009714
- (3S)-3-aminoheptan-1-ol;hydrochloride
-
- Inchi： 1S/C7H17NO.ClH/c1-2-3-4-7(8)5-6-9;/h7,9H,2-6,8H2,1H3;1H/t7-;/m0./s1
- InChI Key： XMYBSLKMJOGNKO-FJXQXJEOSA-N
- SMILES： Cl.OCC[C@H](CCCC)N
Computed Properties
- Exact Mass: 167.1076919g/mol
- Monoisotopic Mass: 167.1076919g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 5
- Complexity: 56.9
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 46.2
(3R)-3-Aminoheptan-1-ol;hydrochloride Related Literature
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
-
Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Kevin M. Koo,Abu Ali Ibn Sina,Laura G. Carrascosa,Muhammad J. A. Shiddiky Analyst, 2014,139, 6178-6184
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Sheng Wang,Wenxian Xie,Xiu Zhang,Xia Zou,Yan Zhang Chem. Commun., 2012,48, 5907-5909
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