Cas no 118333-27-0 (D-Alanine,N-(1-methylethyl)-)
D-Alanine,N-(1-methylethyl)- structure
Product Name:D-Alanine,N-(1-methylethyl)-
CAS No:118333-27-0
MF:C6H13NO2
MW:131.172921895981
CID:132918
PubChem ID:20848039
Update Time:2025-04-19
D-Alanine,N-(1-methylethyl)- Chemical and Physical Properties
Names and Identifiers
-
- D-Alanine,N-(1-methylethyl)-
- D-Alanine, N-(1-methylethyl)- (9CI)
- 118333-27-0
- (2R)-2-(isopropylamino)propanoic acid, AldrichCPR
- (2R)-2-(propan-2-ylamino)propanoic acid
- (2R)-2-(ISOPROPYLAMINO)PROPANOIC ACID
- SCHEMBL4621286
- (R)-2-(isopropylamino)propanoic acid
-
- Inchi： 1S/C6H13NO2/c1-4(2)7-5(3)6(8)9/h4-5,7H,1-3H3,(H,8,9)/t5-/m1/s1
- InChI Key： LABFFVKLPSJCAN-RXMQYKEDSA-N
- SMILES： OC([C@@H](C)NC(C)C)=O
Computed Properties
- Exact Mass: 131.09469
- Monoisotopic Mass: 131.094628657g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 9
- Rotatable Bond Count: 3
- Complexity: 101
- 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: -1.7
- Topological Polar Surface Area: 49.3?2
Experimental Properties
- PSA: 49.33
D-Alanine,N-(1-methylethyl)- Related Literature
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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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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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
118333-27-0 (D-Alanine,N-(1-methylethyl)-) Related Products
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- 56857-47-7(Strombine)
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- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
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