Basic information
- CAS
124717-60-8- Standard SMILES
Cc1ccc(C2OCCO2)cc1Br- InChIKey
YTQXPAWDHPRBBM-UHFFFAOYSA-N- Molecular formula
- C10H11BrO2
- Average molar mass
- 243.1 g/mol
- Monoisotopic mass
- 241.99424169
Names & identifiers
- Preferred name
- 1,3-Dioxolane, 2-(3-bromo-4-methylphenyl)-
- IUPAC
- 2-(3-bromo-4-methylphenyl)-1,3-dioxolane
- English name
- 2-(3-bromo-4-methylphenyl)-1,3-dioxolane
- Molecular formula
- C10H11BrO2
- Molecular weight
- 243.1
Names & synonyms
124717-60-81,3-Dioxolane, 2-(3-bromo-4-methylphenyl)-DTXSID10459863RefChem:218924DTXCID204106822-(3-bromo-4-methylphenyl)-1,3-dioxolaneMFCD279425382-(3-bromo-4-methyl-phenyl)-1,3-dioxolaneSCHEMBL2856571YTQXPAWDHPRBBM-UHFFFAOYSA-NDA-284892-(3-Bromo-4-methylphenyl)[1,3]dioxolane
Show more names
CS-0193362E93217F631007
Database identifiers
- CAS
124717-60-8- PubChem CID
- 11241979
- DTXSID
DTXSID10459863
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 168
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers2 total
南京雅科伦医药科技有限公司025-66096098 3165145969 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
3 records
Compound notes
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