Benzyl benzyl(but-3-yn-1-yl)carbamate
Basic information
- CAS
107301-62-2- Standard SMILES
C#CCCN(Cc1ccccc1)C(=O)OCc1ccccc1- InChIKey
QZATZGLFROIEMR-UHFFFAOYSA-N- Molecular formula
- C19H19NO2
- Average molar mass
- 293.4 g/mol
- Monoisotopic mass
- 293.14157885
Names & identifiers
- Preferred name
- Benzyl benzyl(but-3-yn-1-yl)carbamate
- IUPAC
- benzyl N-benzyl-N-but-3-ynylcarbamate
Names & synonyms
DTXSID801214864Benzyl benzyl(but-3-yn-1-yl)carbamate107301-62-2Phenylmethyl N-3-butyn-1-yl-N-(phenylmethyl)carbamate
Database identifiers
- CAS
107301-62-2- PubChem CID
- 13788397
- DTXSID
DTXSID801214864- Nikkaji
- J3.643.525I
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 372
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Compound notes
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