Ethyl hydrogen (1-phenylpropyl)carbonohydrazonate
Basic information
- CAS
69353-14-6- Standard SMILES
CCOC(=O)NNC(CC)c1ccccc1- InChIKey
IBGZAFPWAXOXGF-UHFFFAOYSA-N- Molecular formula
- C12H18N2O2
- Average molar mass
- 222.28 g/mol
- Monoisotopic mass
- 222.13682782
Names & identifiers
- Preferred name
- Ethyl hydrogen (1-phenylpropyl)carbonohydrazonate
- IUPAC
- ethyl N-(1-phenylpropylamino)carbamate
- English name
- 3-(α-Ethylbenzyl)carbazic acid ethyl ester
- Molecular formula
- C12H18N2O2
- Molecular weight
- 222.28352
Names & synonyms
69353-14-6DTXSID60989100Ethyl hydrogen (1-phenylpropyl)carbonohydrazonateRefChem:1085048DTXCID401416230Ethyl 3-(alpha-ethylbenzyl)carbazateBRN 0651026CARBAZIC ACID, 3-(alpha-ETHYLBENZYL)-, ETHYL ESTER3-(α-Ethylbenzyl)carbazic acid ethyl ester
Database identifiers
- CAS
69353-14-6- PubChem CID
- 50414
- DTXSID
DTXSID60989100- Nikkaji
- J69.472J
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 50.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 203
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Compound notes
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