Basic information
- CAS
3418-21-1- Standard SMILES
BrCC1(c2ccccc2)OCCO1- InChIKey
NTRATOUBIPAKPQ-UHFFFAOYSA-N- Molecular formula
- C10H11BrO2
- Average molar mass
- 243.1 g/mol
- Monoisotopic mass
- 241.99424
Names & identifiers
- Preferred name
- 2-(Bromomethyl)-2-phenyl-1,3-dioxolane
- IUPAC
- 2-(bromomethyl)-2-phenyl-1,3-dioxolane
- English name
- 2-(BROMOMETHYL)-2-PHENYL-1,3-DIOXOLANE
- Molecular formula
- C10H11BrO2
- Molecular weight
- 243.1
Names & synonyms
2-(bromomethyl)-2-phenyl-1,3-dioxolane3418-21-1DTXSID40303128RefChem:1061488DTXCID802542611,3-Dioxolane,2-(bromomethyl)-2-phenyl-MFCD002252092-Bromomethyl-2-phenyl[1,3]dioxolane1,3-Dioxolane, 2-(bromomethyl)-2-phenyl-NSC1568812-bromomethyl-2-phenyl-1,3-dioxolaneBionet2_000949
Show more names
2-(BROMOMETHYL)-2-PHENVL-1,3-DIOXOLANE
phenacyl bromide ethyleneketalSCHEMBL169659bromoacetophenone ethylene ketalHMS1366L03SBB099681AKOS005069193NSC-156881DA-19578
Database identifiers
- CAS
3418-21-1- PubChem CID
- 291574
- DTXSID
DTXSID40303128- Nikkaji
- J1.429.129F
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 160
Physicochemical properties
- Melting point
- 63 · 63-65°
- Boiling point
- 109 °C · 109 °C(Press: 0.05 Torr)
- Density
- 1.449 · 1.449±0.06 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2–8 °C
- Appearance
- Off-white to light yellow Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 317 · H317-H319
- Precautionary statements
- 280 · P280-P305+P351+P338
- HazardClass
- IRRITANT
- HS Code
- 2932990090 · 2932990090
Safety & regulation
Safety data
- hs_code
- 2932990090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- IRRITANT
- Hazard statements
- H317-H319
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers18 total
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [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]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
上海任跃化学科技有限公司021-62219190; 18321139117 · [email protected]
Hebei Ganmiao New material Technology Co., LTD+86-17332992504 · [email protected]
Shaanxi Dideu New Materials Co. Ltd18192503167 · [email protected]
苏州碳壹科技有限公司18606219109;18606219109 · [email protected]
合肥钼凯医药科技有限公司
Related reactions
8 records
Compound notes
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