Basic information
- CAS
25216-04-0- Standard SMILES
C#CCOC(=O)Nc1ccc(C)cc1- InChIKey
ORRPYYREPDPJNU-UHFFFAOYSA-N- Molecular formula
- C11H11NO2
- Average molar mass
- 189.21 g/mol
- Monoisotopic mass
- 189.07897859
Names & identifiers
- Preferred name
- Prop-2-yn-1-yl p-tolylcarbamate
- IUPAC
- prop-2-ynyl N-(4-methylphenyl)carbamate
- English name
- p-Tolyl-carbamic acid prop-2-ynyl ester
- Molecular formula
- C11H11NO2
- Molecular weight
- 189.21
Names & synonyms
Prop-2-yn-1-yl p-tolylcarbamate25216-04-0prop-2-ynyl N-(4-methylphenyl)carbamateP-TOLYL-CARBAMIC ACID PROP-2-YNYL ESTERNSC106527SCHEMBL94640SCHEMBL10192052DTXSID50948069AKOS002231020NSC-106527Prop-2-yn-1-yl (4-methylphenyl)carbamateN-(4-methylphenyl)prop-2-ynyloxycarboxamide
Show more names
Carbamic acid, N-(4-methylphenyl)-, 2-propyn-1-yl ester
ST50110552
Database identifiers
- CAS
25216-04-0- PubChem CID
- 267341
- DTXSID
DTXSID50948069
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 233
Chemistry & industry
Suppliers5 total
APAC Pharmaceutical, LLC[email protected]
Leancare Ltd.[email protected]
AlliChem, LLC[email protected]
CHEMPACIFIC[email protected]
3B Scientific Corporation[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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