Basic information
- CAS
3938-29-2- Standard SMILES
CNC(=O)Oc1ccc(OC)cc1- InChIKey
PFPSRAGMOKCNIC-UHFFFAOYSA-N- Molecular formula
- C9H11NO3
- Average molar mass
- 181.19 g/mol
- Monoisotopic mass
- 181.07389321
Names & identifiers
- Preferred name
- 4-Methoxyphenyl methylcarbamate
- IUPAC
- (4-methoxyphenyl) N-methylcarbamate
Names & synonyms
4-methoxyphenyl methylcarbamate3938-29-2Phenol, 4-methoxy-, methylcarbamate(4-methoxyphenyl) N-methylcarbamateNSC35391methylcarbamic acid 4-methoxyphenyl esterAI3-25854SCHEMBL9326191PFPSRAGMOKCNIC-UHFFFAOYSA-DTXSID60192576PFPSRAGMOKCNIC-UHFFFAOYSA-NNSC 35391
Show more names
NSC-35391AKOS029948095DS-007782InChI=1/C9H11NO3/c1-10-9(11)13-8-5-3-7(12-2)4-6-8/h3-6H,1-2H3,(H,10,11)
Database identifiers
- CAS
3938-29-2- PubChem CID
- 77541
- DTXSID
DTXSID60192576- Nikkaji
- J747.742B
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 164
Experimental & physicochemical properties
LogP1.23
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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