Basic information
- CAS
1129-62-0- Standard SMILES
CCC(C)=NNc1ccccc1- InChIKey
BPAJPMUNAALLEK-UHFFFAOYSA-N- Molecular formula
- C10H14N2
- Average molar mass
- 162.23 g/mol
- Monoisotopic mass
- 162.11569846
Overview
See also: 2-Butanone, 2-phenylhydrazone (annotation moved to).
Names & identifiers
- Preferred name
- Butan-2-one phenylhydrazone
- IUPAC
- N-(butan-2-ylideneamino)aniline
- English name
- butan-2-one phenylhydrazone
- Molecular formula
- C10H14N2
- Molecular weight
- 162.23
Names & synonyms
BUTAN-2-ONE PHENYLHYDRAZONEN-(butan-2-ylideneamino)anilineSCHEMBL11872753DTXSID30859583BPAJPMUNAALLEK-UHFFFAOYSA-Nmethyl ethyl ketone phenylhydrazone1-(Butan-2-ylidene)-2-phenylhydrazineDB-243176Einecs 214-452-32-Butanone,phenylhydrazone2-Butanone, 2-phenylhydrazone
Database identifiers
- CAS
1129-62-0- PubChem CID
- 101985
- DTXSID
DTXSID30859583
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 24.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 146
Physicochemical properties
- Melting point
- 116 · 116-118 °C
- Boiling point
- 146 °C · 146 °C(Press: 16 Torr)
- Density
- 0.94 · 0.940±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 16.482 · 16.482±0.10(predicted)
- EPA Substance Registry System
- 2 · 2-Butanone, phenylhydrazone (1129-62-0)
- TSCA
- TSCA listed
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
- tsca
- TSCA listed
Chemistry & industry
Suppliers2 total
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
Shaanxi Dideu Medichem Co. Ltd+86-17392712779 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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