Basic information
- CAS
604-50-2- Standard SMILES
Cn1c(=O)[nH]c(=O)c2ccccc21- InChIKey
RWFOOMQYIRITHL-UHFFFAOYSA-N- Molecular formula
- C9H8N2O2
- Average molar mass
- 176.17 g/mol
- Monoisotopic mass
- 176.0585775
Names & identifiers
- Preferred name
- Glycosmicine
- IUPAC
- 1-methylquinazoline-2,4-dione
- English name
- 1-methylquinazoline-2,4(1H,3H)-dione
- Molecular formula
- C9H8N2O2
- Molecular weight
- 176.17
Names & synonyms
Glycosmicine1-Methyl-2,4(1H,3H)-quinazolinedione2,4(1H,3H)-QUINAZOLINEDIONE, 1-METHYL-NSC 401254Methyl-1 (1H,3H)quinazolinedione-2,4Methyl-1 (1H,3H)quinazolinedione-2,4 [French]DTXSID20209154RefChem:143931DTXCID40131645RWFOOMQYIRITHL-UHFFFAOYSA-N604-50-21-methylquinazoline-2,4(1H,3H)-dione
Show more names
1-methylquinazoline-2,4-quinone
1-methylquinazoline-2,4-dioneMFCD007310301-methyl-1,3-dihydroquinazoline-2,4-dioneNSC4012542,4(1H,3H)-Quinazolinedione,1-methyl-1,2,3,4-tetrahydro-1-methyl-2,4-dioxoquinazoline1-methyl-1,2,3,4-tetrahydroquinazoline-2,4-dioneSCHEMBL5033264
Database identifiers
- CAS
604-50-2- PubChem CID
- 11788
- DTXSID
DTXSID20209154- Nikkaji
- J13.470H
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 49.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 252
Physicochemical properties
- storage temp.
- Inert atmosphere,Room Temperature
- Appearance
- White to off-white Solid
- EWG's Food Scores
- 1 · 1
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers23 total
上海康恩博医药科技有限公司17510465506 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
上海合寰化工科技有限公司18621911604 · [email protected]
衢州爱美康生物科技有限公司0570-3081766 18357083060 · [email protected]
Guangzhou Yuheng Pharmaceutical Technology Co., Ltd
Related reactions
7 records
Compound notes
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