Cas no 136019-12-0 (Hydroxypropyl-beta-cyclodextrin)
136019-12-0 structure
Product Name:Hydroxypropyl-beta-cyclodextrin
CAS No:136019-12-0
MF:C9H11NO2
MW:165.189142465591
CID:134921
PubChem ID:6925665
Update Time:2025-04-19
Hydroxypropyl-beta-cyclodextrin Chemical and Physical Properties
Names and Identifiers
-
- Hydroxypropyl-beta-cyclodextrin
- (2S)-2-azaniumyl-3-phenylpropanoate
- 136019-12-0
- 2S-alpha-phenylalanine
- CHEBI:58095
- SCHEMBL23141074
- Endorphenyl
- (2S)-2-ammonio-3-phenylpropanoate
- L-phenylalanine zwitterion
-
- Inchi： 1S/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/t8-/m0/s1
- InChI Key： COLNVLDHVKWLRT-QMMMGPOBSA-N
- SMILES： [O-]C([C@H](CC1C=CC=CC=1)[NH3+])=O
Computed Properties
- Exact Mass: 165.078978594g/mol
- Monoisotopic Mass: 165.078978594g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 147
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.9
- Topological Polar Surface Area: 67.8?2
Experimental Properties
- Melting Point: 278?°C (dec.)
- Solubility: H2O: 45?% (w/v)
- LogP: -1.38
Hydroxypropyl-beta-cyclodextrin Related Literature
-
Meng-xiang Su,Zhong-ying Liu,Jin-long Chen,Li-fei Cheng,Bo Li,Fang Yan,Bin Di RSC Adv. 2014 4 54998
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Edward B. Skibo,Akmal Jamil,Brittany Austin,Douglas Hansen,Armand Ghodousi Org. Biomol. Chem. 2010 8 1577
-
Madleen Busse,Emily Border,Peter C. Junk,Richard L. Ferrero,Philip C. Andrews Dalton Trans. 2014 43 17980
-
Sara K. Murase,Nurit Haspel,Luis J. del Valle,Eric A. Perpète,Catherine Michaux,Ruth Nussinov,Jordi Puiggalí,Carlos Alemán RSC Adv. 2014 4 23231
-
Rajender Kumar,Ravi Bhushan RSC Adv. 2014 4 50130
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