Basic information
- Standard SMILES
O=c1[nH]c2ccccc2c(=O)n1CCO- InChIKey
DSUNWRHRAQZLNC-UHFFFAOYSA-N- Molecular formula
- C10H10N2O3
- Average molar mass
- 206.2 g/mol
- Monoisotopic mass
- 206.06914218
Names & identifiers
- Preferred name
- 3-(2-hydroxyethyl)-1H,3H-quinazoline-2,4-dione
- IUPAC
- 3-(2-hydroxyethyl)-1H-quinazoline-2,4-dione
- English name
- 3-(2-Hydroxyethyl)-2,4-(1H,3H)-quinazoline-dione
- Molecular formula
- C10H10N2O3
- Molecular weight
- 206.2
Names & synonyms
1207-75-63-(2-Hydroxyethyl)-1H,3H-quinazoline-2,4-dione3-(2-Hydroxyethyl)-2,4(1H,3H)-quinazolinedioneEINECS 214-897-3DTXSID10152968RefChem:491080DTXCID4075459214-897-33-(2-hydroxyethyl)quinazoline-2,4(1H,3H)-dione3-(2-hydroxyethyl)-1,2,3,4-tetrahydroquinazoline-2,4-dione3-(2-hydroxyethyl)-1H-quinazoline-2,4-dione3-(2-Hydroxyethyl)-2,4-(1H,3H)-quinazoline-dione
Show more names
3-(2-HYDROXYETHYL)QUINAZOLINE-2,4-DIONE3-(2-hydroxyethyl)-1H-quinazoline-2,4-quinone
2,4(1h,3h)-quinazolinedione, 3-(2-hydroxyethyl)-MFCD000525972,4(1H,3H)-Quinazolinedione,3-(2-hydroxyethyl)-A6Y7JRT9PMOprea1_634207orb3136974SCHEMBL5878601ALBB-024252
Database identifiers
- CAS
1207-75-6- PubChem CID
- 71016
- DTXSID
DTXSID10152968- UNII
- A6Y7JRT9PM
- EC Number
- 214-897-3
- Nikkaji
- J217.059K
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 69.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 280
Physicochemical properties
- Melting point
- 253.5 · 253.5-254 °C(Solv: water (7732-18-5); acetic acid (64-19-7))
- Density
- 1.361 · 1.361±0.06 g/cm3(Predicted)
- vapor pressure
- 0 · 0-0Pa at 20-25℃
- form
- Solid:particulate/powder
- pka
- 12.67 · 12.67±0.20(Predicted)
- LogP
- 0.6 at · 0.6 at 20℃ and pH7.6-7.8
- FDA UNII
- 6 Y7JRT9PM · A6Y7JRT9PM
- REACH Registrations
- Active
Safety & regulation
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 50% (1 of 2) of reports.
Warning
H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory InformationREACH registered substance: 3-(2-hydroxyethyl)-1H,3H-quinazoline-2,4-dione (EC: 214-897-3)
Hazard Classes and CategoriesAcute Tox. 4 (50%)
Safety data
- REACH Registrations
- Active
Chemistry & industry
Suppliers14 total
无锡丽恒昇生物医药科技有限公司15250805028 15250805028 · [email protected]
天津泛德科技发展有限公司15620920485; 15620920485 · [email protected]
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
赛纳斯特化学（欢迎点击联系）021-60343070
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 13913916777 · [email protected]
常州安赛普化工有限公司0519-86305871 13961213398 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
江苏法安德医药科技有限公司18168426372 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
南京沃格尼化工有限公司15996452985 · [email protected]
江苏博思特化工科技有限公司87161895 15651337098 · [email protected]
南通润丰石油化工有限公司66814565 18912298907 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
1 records
Linked notes
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