Basic information
- CAS
10156-28-2- Standard SMILES
CC(Cc1ccc(Cl)cc1Cl)OC(N)=O- InChIKey
RZEBAIJIWIUHDM-UHFFFAOYSA-N- Molecular formula
- C10H11Cl2NO2
- Average molar mass
- 248.1 g/mol
- Monoisotopic mass
- 247.016684
Names & identifiers
- Preferred name
- Carbamic acid, 2,4-dichloro-alpha-methylphenethyl ester
- IUPAC
- 1-(2,4-dichlorophenyl)propan-2-yl carbamate
- English name
- Carbamic acid 2,4-dichloro-α-methylphenethyl ester
- Molecular formula
- C10H11Cl2NO2
- Molecular weight
- 248.10584
Names & synonyms
10156-28-2CARBAMIC ACID, 2,4-DICHLORO-alpha-METHYLPHENETHYL ESTERRefChem:1080855Carbamic acid 2,4-dichloro-alpha-methylphenethyl ester1-(2,4-dichlorophenyl)propan-2-yl carbamateMH 1767BRN 1879844DTXSID409063151-(2,4-Dichlorophenyl)propan-2-yl hydrogen carbonimidateCarbamic acid 2,4-dichloro-α-methylphenethyl esterBenzeneethanol, 2,4-dichloro-α-methyl-, 1-carbamate
Database identifiers
- CAS
10156-28-2- PubChem CID
- 25013
- DTXSID
DTXSID40906315- Nikkaji
- J42.878G
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 52.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 225
Physicochemical properties
- Melting point
- 102 · 102-103 °C
- Boiling point
- 395.2 · 395.2±32.0 °C(Predicted)
- Density
- 1.328 · 1.328±0.06 g/cm3(Predicted)
- pka
- 13.25 · 13.25±0.50(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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