Cas no 6018-54-8 (Alanine, 3-amino-)
Alanine, 3-amino- structure
Product Name:Alanine, 3-amino-
CAS No:6018-54-8
MF:C3H8N2O2
MW:104.107820510864
CID:512635
Update Time:2025-04-19
Alanine, 3-amino- Chemical and Physical Properties
Names and Identifiers
-
- Alanine, 3-amino-
- 2,3-Diaminopropanoic acid
- 2,3-Diaminopropionic acid
- 2-Amino-b-alanine
- a,b-Diaminopropionic acid
- b-Alanine, 2-amino-
- b-Aminoalanine
- DL-2,3-Diaminopropanoicacid
- DL-2,3-Diaminopropionic acid
- DL-3-Aminoalanine
- DL-a,b-Diaminopropionic acid
- DL-Alanine, 3-amino-
- Propanoic acid, 2,3-diamino-
- Propionicacid, 2,3-diamino- (6CI,8CI)
-
- Inchi： 1S/C3H8N2O2/c4-1-2(5)3(6)7/h2H,1,4-5H2,(H,6,7)
- InChI Key： PECYZEOJVXMISF-UHFFFAOYSA-N
- SMILES： NCC(C(=O)O)N
Computed Properties
- Exact Mass: 104.05864
- Monoisotopic Mass: 104.058578
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 7
- Rotatable Bond Count: 2
- Complexity: 73.3
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 89.3
Experimental Properties
- PSA: 89.34
Alanine, 3-amino- Related Literature
-
Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
-
Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
-
Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
6018-54-8 (Alanine, 3-amino-) Related Products
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