Basic information
- CAS
834-17-3- Standard SMILES
Cc1cccc(OCc2ccccc2)c1- InChIKey
FRQUHSBKTAMSDF-UHFFFAOYSA-N- Molecular formula
- C14H14O
- Average molar mass
- 198.26 g/mol
- Monoisotopic mass
- 198.10446507
Names & identifiers
- Preferred name
- m-(Benzyloxy)toluene
- IUPAC
- 1-methyl-3-phenylmethoxybenzene
- English name
- m-(benzyloxy)toluene
- Molecular formula
- C14H14O
- Molecular weight
- 198.26
Names & synonyms
m-(Benzyloxy)toluene834-17-3Benzene, 1-methyl-3-(phenylmethoxy)-1-(Benzyloxy)-3-methylbenzene1-methyl-3-phenylmethoxybenzene1-benzyloxy-3-methyl-benzeneBenzene,1-methyl-3-(phenylmethoxy)-3ELF78FA8T3-(BENZYLOXY)TOLUENEEINECS 212-635-21-METHYL-3-(PHENYLMETHOXY)BENZENEUNII-3ELF78FA8T
Show more names
m-Tolylbenzyl ether3-Methylphenylbenzyl ether3-Methyl-1-benzyloxybenzene
Benzyl 3-methylphenyl ether1-benzyloxy-3-methylbenzeneSCHEMBL97885SCHEMBL539028SCHEMBL685837SCHEMBL2264253SCHEMBL5542080SCHEMBL7285346
Database identifiers
- CAS
834-17-3- PubChem CID
- 70035
- DTXSID
DTXSID30232317- UNII
- 3ELF78FA8T
- EC Number
- 212-635-2
- Nikkaji
- J195.104A
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 172
Physicochemical properties
- Melting point
- 43 °C · 43 °C
- Boiling point
- 142 · 142-150 °C(Press: 5 Torr)
- Density
- 1.041 · 1.041±0.06 g/cm3(Predicted)
- FDA UNII
- 3 ELF78FA8T · 3ELF78FA8T
Chemistry & industry
Suppliers5 total
郑州康弗辰医药科技有限公司18210788515; 18210788515 · [email protected]
Aromsyn Co., Ltd.+86-0571-85585865 +86-13336024896 · [email protected]
烟台盛凯伦化学科技有限公司开发区第一分公司13356901049 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
2 records
Compound notes
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