Basic information
- CAS
38580-89-1- Standard SMILES
CC(C)OC(=O)N(C)C- InChIKey
XFWJFSJDRURPLE-UHFFFAOYSA-N- Molecular formula
- C6H13NO2
- Average molar mass
- 131.17 g/mol
- Monoisotopic mass
- 131.09462866
Names & identifiers
- Preferred name
- Isopropyl dimethylcarbamate
- IUPAC
- propan-2-yl N,N-dimethylcarbamate
- English name
- isopropyl dimethylcarbamate
- Molecular formula
- C6H13NO2
- Molecular weight
- 131.17
Names & synonyms
Isopropyl dimethylcarbamate38580-89-1propan-2-yl N,N-dimethylcarbamateisopropyl N,N-dimethylcarbamateCarbamic acid, ethyl-, 1-methylethyl esterisopropyldimethylcarbamateCarbamic acid, dimethyl-, 1-methylethyl esterNSC29663EINECS 254-013-3AI3-25330Propan-2-yl dimethylcarbamateSCHEMBL6244866
Show more names
dimethylaminomacetic acidisopropyl esterDimethylcarbamic acid 1-methylethyl esterCarbamic acid, N,N-dimethyl-, 1-methylethyl ester
DTXSID00191902XFWJFSJDRURPLE-UHFFFAOYSA-NMFCD22571543NSC 29663NSC-29663AKOS015995141AS-58991DS-007394
Database identifiers
- CAS
38580-89-1- PubChem CID
- 95685
- DTXSID
DTXSID00191902- EC Number
- 254-013-3
- Nikkaji
- J294.707B
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 99.2
Experimental & physicochemical properties
LogP1.38
Physicochemical properties
- Boiling point
- 144.7 · 144.7±7.0 °C(Predicted)
- Density
- 0.945 · 0.945±0.06 g/cm3(Predicted)
- pka
- -1.25 · -1.25±0.70(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers5 total
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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