Carbonic acid, methyl 4-methylphenyl ester
Basic information
- CAS
1848-01-7- Standard SMILES
COC(=O)Oc1ccc(C)cc1- InChIKey
FLSOKBQNISCLMI-UHFFFAOYSA-N- Molecular formula
- C9H10O3
- Average molar mass
- 166.17 g/mol
- Monoisotopic mass
- 166.06299418
Names & identifiers
- Preferred name
- Carbonic acid, methyl 4-methylphenyl ester
- IUPAC
- methyl (4-methylphenyl) carbonate
- English name
- Carbonic acid methyl 4-methylphenyl ester
- Molecular weight
- 0
Names & synonyms
1848-01-7Carbonic acid, methyl 4-methylphenyl esterMethyl 4-methylphenyl carbonateCarbonic acid methyl 4-methylphenyl esterMethyl p-tolyl carbonatemethyl (4-methylphenyl) carbonateCarbonic acid, methyl p-tolyl esterSCHEMBL1598492SCHEMBL7543901SCHEMBL26622125DTXSID50339337FLSOKBQNISCLMI-UHFFFAOYSA-N
Database identifiers
- CAS
1848-01-7- PubChem CID
- 555489
- DTXSID
DTXSID50339337- Nikkaji
- J129.327C
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 148
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Related reactions
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Compound notes
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