Basic information
- CAS
4790-83-4- Standard SMILES
CNC(=O)Oc1cccc2c1OCC2- InChIKey
KZSIVIPKLYWTDQ-UHFFFAOYSA-N- Molecular formula
- C10H11NO3
- Average molar mass
- 193.2 g/mol
- Monoisotopic mass
- 193.07389321
Names & identifiers
- Preferred name
- Carbamic acid, methyl-, 2,3-dihydro-7-benzofuranyl ester
- IUPAC
- 2,3-dihydro-1-benzofuran-7-yl N-methylcarbamate
- English name
- N-Methylcarbamic acid 2,3-dihydrobenzofuran-7-yl ester
- Molecular formula
- C10H11NO3
- Molecular weight
- 193.2
Names & synonyms
BRN 13757184790-83-4CARBAMIC ACID, METHYL-, 2,3-DIHYDRO-7-BENZOFURANYL ESTER2,3-Dihydrobenzofuranyl-7 N-methylcarbamateDTXSID301973315-17-04-00013 (Beilstein Handbook Reference)RefChem:332530DTXCID40119822N-Methylcarbamic acid 2,3-dihydrobenzofuran-7-yl esterdihydro-7-benzofuranyl-N-methylcarbamate2,3-Dihydro-1-benzofuran-7-yl methylcarbamateFenoxaprop-ethyl Impurity 3 (Fenoxaprop P-Ethyl)
Show more names
7-Benzofuranol, 2,3-dihydro-, 7-(N-methylcarbamate)
Database identifiers
- CAS
4790-83-4- PubChem CID
- 20922
- DTXSID
DTXSID30197331- Nikkaji
- J42.905H
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 219
Physicochemical properties
- Melting point
- 145 · 145-147 °C
- Boiling point
- 307 · 307.0±42.0 °C(Predicted)
- Density
- 1.238 · 1.238±0.06 g/cm3(Predicted)
- pka
- 12.28 · 12.28±0.46(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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