Isopropyl 2,4-dimethylphenylcarbamate
Basic information
- CAS
6622-37-3- Standard SMILES
Cc1ccc(NC(=O)OC(C)C)c(C)c1- InChIKey
BMXCXCVYHRXVQI-UHFFFAOYSA-N- Molecular formula
- C12H17NO2
- Average molar mass
- 207.27 g/mol
- Monoisotopic mass
- 207.12592879
Overview
See also: Isopropyl N-(2,4-xylyl)carbamate (annotation moved to).
Names & identifiers
- Preferred name
- Isopropyl 2,4-dimethylphenylcarbamate
- IUPAC
- propan-2-yl N-(2,4-dimethylphenyl)carbamate
- English name
- NSC57710
- Molecular formula
- C12H17NO2
- Molecular weight
- 207.26888
Names & synonyms
6622-37-3NSC57710isopropyl 2,4-dimethylphenylcarbamateSCHEMBL15108154DTXSID10984706NSC-57710AKOS024334487Propan-2-yl hydrogen (2,4-dimethylphenyl)carbonimidateISOPROPYL N-(2,4-XYLYL)CARBAMATE
Database identifiers
- CAS
6622-37-3- PubChem CID
- 245602
- DTXSID
DTXSID10984706
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 216
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Suppliers
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Related reactions
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Compound notes
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