Cas no 102909-15-9 (Carbamic acid,(4,6-dimethoxy-2-pyrimidinyl)- (9CI))
102909-15-9 structure
Product Name:Carbamic acid,(4,6-dimethoxy-2-pyrimidinyl)- (9CI)
CAS No:102909-15-9
MF:C7H9N3O4
MW:199.164061307907
CID:125345
PubChem ID:19981623
Update Time:2025-04-18
Carbamic acid,(4,6-dimethoxy-2-pyrimidinyl)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Carbamic acid,(4,6-dimethoxy-2-pyrimidinyl)- (9CI)
- Carbamic acid, (4,6-dimethoxy-2-pyrimidinyl)- (9CI)
- (4,6-Dimethoxypyrimidin-2-yl)carbamic acid
- (4,6-Dimethoxypyrimidin-2-yl)carbamicacid
- SCHEMBL3791688
- 102909-15-9
-
- Inchi： 1S/C7H9N3O4/c1-13-4-3-5(14-2)9-6(8-4)10-7(11)12/h3H,1-2H3,(H,11,12)(H,8,9,10)
- InChI Key： LVTUHHUARVWVOF-UHFFFAOYSA-N
- SMILES： O(C)C1C=C(N=C(NC(=O)O)N=1)OC
Computed Properties
- Exact Mass: 199.05937
- Monoisotopic Mass: 199.05930578g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 189
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.4
- Topological Polar Surface Area: 93.6?2
Experimental Properties
- PSA: 93.57
Carbamic acid,(4,6-dimethoxy-2-pyrimidinyl)- (9CI) Related Literature
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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