Completing data — usually done within a minute
Basic information
- CAS
57009-13-9- Standard SMILES
COC(=O)c1ccccc1OC(C)C- InChIKey
RDAALIJZJHPRRP-UHFFFAOYSA-N- Molecular formula
- C11H14O3
- Average molar mass
- 194.23 g/mol
- Monoisotopic mass
- 194.09429431
Names & identifiers
- Preferred name
- Methyl 2-propan-2-yloxybenzoate
- IUPAC
- methyl 2-propan-2-yloxybenzoate
Names & synonyms
Methyl 2-isopropoxybenzoate57009-13-9methyl 2-propan-2-yloxybenzoatemethyl 2-(propan-2-yloxy)benzoateNSC406658Methyl2-isopropoxybenzoatemethyl 2-isopropoxy-benzoateSCHEMBL4036585SCHEMBL4286287DTXSID60324411Methyl 2-(1-methylethoxy)benzoateMFCD20527431
Show more names
AKOS000348749Methyl 2-[(propan-2-yl)oxy]benzoateNSC 406658NSC-406658DB-430662Benzoic acid, 2-(isopropyl)oxy-, methyl ester
Database identifiers
- CAS
57009-13-9- PubChem CID
- 347797
- DTXSID
DTXSID60324411
Properties
Computed structural propertiesFilling in
- XLogP
- 2.8
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 189
Chemistry & industry
Suppliers4 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
郑州为易化工产品有限公司0371-88888888 qq272369594;2159423853qq · [email protected]
成都圣美凯生物科技有限公司028-85157043 15882256948 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
5 records
Compound notes
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