Basic information
- CAS
25755-06-0- Standard SMILES
COC(=O)c1ccccc1OCC1CC1- InChIKey
NWAJIZXDHCRFDA-UHFFFAOYSA-N- Molecular formula
- C12H14O3
- Average molar mass
- 206.24 g/mol
- Monoisotopic mass
- 206.0942943
Names & identifiers
- Preferred name
- Methyl 2-(cyclopropylmethoxy)benzoate
- IUPAC
- methyl 2-(cyclopropylmethoxy)benzoate
- English name
- 2-(cyclopropylmethoxy)benzoic acid methyl ester
- Molecular formula
- C12H14O3
- Molecular weight
- 206.24
Names & synonyms
25755-06-02-(cyclopropylmethoxy)benzoic acid methyl esterMETHYL 2-(CYCLOPROPYLMETHOXY)BENZOATEDTXSID50696972Benzoic acid, 2-(cyclopropylmethoxy)-, methyl ester
Database identifiers
- CAS
25755-06-0- PubChem CID
- 53415134
- DTXSID
DTXSID50696972
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 223
Physicochemical properties
- Boiling point
- 304.9 · 304.9±15.0 °C(Predicted)
- Density
- 1.142 · 1.142±0.06 g/cm3(Predicted)
Chemistry & industry
Suppliers3 total
安徽合诺生物科技有限公司0555-2761852
郑州康弗辰医药科技有限公司18210788515; 18210788515 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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