Cas no 30382-25-3 (L-Glutamine,N-(3,4-dioxo-1,5-cyclohexadien-1-yl)-)
30382-25-3 structure
Product Name:L-Glutamine,N-(3,4-dioxo-1,5-cyclohexadien-1-yl)-
CAS No:30382-25-3
MF:C11H12N2O5
MW:252.223382949829
CID:309447
PubChem ID:193125
Update Time:2025-04-19
L-Glutamine,N-(3,4-dioxo-1,5-cyclohexadien-1-yl)- Chemical and Physical Properties
Names and Identifiers
-
- L-Glutamine,N-(3,4-dioxo-1,5-cyclohexadien-1-yl)-
- (2S)-5-amino-2-[(3,4-dioxocyclohexa-1,5-dien-1-yl)amino]-5-oxopentanoic acid
- 30382-25-3
- DTXSID10952728
- N-(3,4-Dioxocyclohexa-1,5-dien-1-yl)-5-hydroxy-5-iminonorvaline
- gamma-L-Glutaminyl-3,4-benzoquinone
- CHEBI:220636
-
- Inchi： 1S/C11H12N2O5/c12-10(16)4-2-7(11(17)18)13-6-1-3-8(14)9(15)5-6/h1,3,5,7,13H,2,4H2,(H2,12,16)(H,17,18)/t7-/m0/s1
- InChI Key： HDPGCJZQWYUKAO-ZETCQYMHSA-N
- SMILES： OC([C@H](CCC(N)=O)NC1C=CC(C(C=1)=O)=O)=O
Computed Properties
- Exact Mass: 252.07466
- Monoisotopic Mass: 252.074622
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 18
- Rotatable Bond Count: 6
- Complexity: 464
- 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: -1.1
- Topological Polar Surface Area: 127
Experimental Properties
- Density: 1.43
- Boiling Point: 576.3°Cat760mmHg
- Flash Point: 302.4°C
- Refractive Index: 1.594
- PSA: 126.56
L-Glutamine,N-(3,4-dioxo-1,5-cyclohexadien-1-yl)- Related Literature
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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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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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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