Cas no 13073-19-3 (L-Homocysteine,S-propyl-)
L-Homocysteine,S-propyl- structure
Product Name:L-Homocysteine,S-propyl-
CAS No:13073-19-3
MF:C7H15NO2S
MW:177.2645008564
CID:147143
PubChem ID:3080689
Update Time:2025-04-19
L-Homocysteine,S-propyl- Chemical and Physical Properties
Names and Identifiers
-
- L-Homocysteine,S-propyl-
- (2S)-2-amino-4-propylsulfanylbutanoic acid
- (2S)-2-amino-4-propylsulfanyl-butanoic acid
- propionine
- S-propyl-L-homocysteine
- DTXSID00156697
- SCHEMBL474910
- (S)-2-Amino-4-(propylthio)butanoic acid
- 2-Amino-4-(propylthio)butyric acid
- S-n-propyl-homocysteine
- 13073-19-3
- L-Propionine
- L-Homocysteine, S-propyl-
-
- Inchi: 1S/C7H15NO2S/c1-2-4-11-5-3-6(8)7(9)10/h6H,2-5,8H2,1H3,(H,9,10)/t6-/m0/s1
- InChI Key: MFCVASZUOWEOHT-LURJTMIESA-N
- SMILES: S(CCC)CC[C@@H](C(=O)O)N
Computed Properties
- Exact Mass: 177.08245
- Monoisotopic Mass: 177.08234989g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 6
- Complexity: 119
- 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: -1
- Topological Polar Surface Area: 88.6?2
Experimental Properties
- PSA: 63.32
L-Homocysteine,S-propyl- Related Literature
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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