Cas no 52019-12-2 (a-D-Glucopyranoside, methyl3-deoxy-3-[[(methylnitrosoamino)carbonyl]amino]-)
52019-12-2 structure
Product Name:a-D-Glucopyranoside, methyl3-deoxy-3-[[(methylnitrosoamino)carbonyl]amino]-
CAS No:52019-12-2
MF:C9H17N3O7
MW:279.247182607651
CID:380697
PubChem ID:291285
Update Time:2025-04-19
a-D-Glucopyranoside, methyl3-deoxy-3-[[(methylnitrosoamino)carbonyl]amino]- Chemical and Physical Properties
Names and Identifiers
-
- a-D-Glucopyranoside, methyl3-deoxy-3-[[(methylnitrosoamino)carbonyl]amino]-
- Glucopyranoside, methyl 3-deoxy-3-(3-methyl-3-nitrosoureido)-, .α.-D-
- DTXSID10303054
- methyl 3-deoxy-3-{[methyl(nitroso)carbamoyl]amino}hexopyranoside
- .alpha.-D-Glucopyranoside, methyl 3-deoxy-3-[[(methylnitrosoamino)carbonyl]amino]-
- 52019-10-0
- NSC-160466
- NSC-156273
- NCI60_001194
- 52019-12-2
- Methyl 3-deoxy-3-({hydroxy[methyl(nitroso)amino]methylidene}amino)hexopyranoside
- NSC160466
- DTXSID00966359
- Altropyranoside, .alpha.-D-
- NSC156273
- CHEMBL1969565
-
- Inchi: 1S/C9H17N3O7/c1-12(11-17)9(16)10-5-6(14)4(3-13)19-8(18-2)7(5)15/h4-8,13-15H,3H2,1-2H3,(H,10,16)
- InChI Key: ITMFEGUZHKHAGY-UHFFFAOYSA-N
- SMILES: O1C(C(C(C(C1CO)O)NC(N(C)N=O)=O)O)OC
Computed Properties
- Exact Mass: 279.107
- Monoisotopic Mass: 279.107
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 19
- Rotatable Bond Count: 3
- Complexity: 329
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 5
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: _0.9
- Topological Polar Surface Area: 141?2
Experimental Properties
- Ionization Potential: 9.61 eV
- Density: 1.45 (AIR= 1)
a-D-Glucopyranoside, methyl3-deoxy-3-[[(methylnitrosoamino)carbonyl]amino]- Related Literature
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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