Cas no 83998-91-8 (Alanine-d4 (9CI))
Alanine-d4 (9CI) structure
Product Name:Alanine-d4 (9CI)
CAS No:83998-91-8
MF:C3H7NO2
MW:93.1178276538849
CID:720950
PubChem ID:16213419
Update Time:2025-04-19
Alanine-d4 (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Alanine-d4 (9CI)
- DL-ALANINE-2,3,3,3-D4
- 2-amino-2,3,3,3-tetradeuteriopropanoic acid
- D98466
- MS-22724
- 2-amino(2,3,3,3-(2)H4)propanoic acid
- alanine-2,3,3,3-d4
- (2,3,3,3-~2~H_4_)Alanine
- DL-Alanine(2,3,3,3-D4)
- (2,3,3,3-(2)H4)alanine
- alanine-d4
- 53795-92-9
- HY-W244382
- 2-amino(?H?)propanoic acid
- (+/-)-2-AMINOPROPIONIC ACID-2,3,3,3-D4
- CS-0370496
- DL-Alanine-2,3,3,3-d4, 98 atom % D
- DTXSID30583937
- CHEBI:143534
- 83998-91-8
- 2-aminopropionic acid-2,3,3,3-d4
-
- Inchi: 1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/i1D3,2D
- InChI Key: QNAYBMKLOCPYGJ-MZCSYVLQSA-N
- SMILES: OC(C([2H])(C([2H])([2H])[2H])N)=O
Computed Properties
- Exact Mass: 93.072785450g/mol
- Monoisotopic Mass: 93.072785450g/mol
- Isotope Atom Count: 4
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 6
- Rotatable Bond Count: 1
- Complexity: 61.8
- 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
- XLogP3: -3
- Topological Polar Surface Area: 63.3?2
Experimental Properties
- Melting Point: 289?°C (dec.)(lit.)
Alanine-d4 (9CI) Related Literature
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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