Basic information
- CAS
71096-80-5- Standard SMILES
C1=COC(C=Nc2ccccc2)CC1- InChIKey
XOCGKHPYQPFRCX-UHFFFAOYSA-N- Molecular formula
- C12H13NO
- Average molar mass
- 187.24 g/mol
- Monoisotopic mass
- 187.09971404
Names & identifiers
- Preferred name
- (E)-1-(3,4-Dihydro-2H-pyran-2-yl)-N-phenylmethanimine
- IUPAC
- 1-(3,4-dihydro-2H-pyran-2-yl)-N-phenylmethanimine
- English name
- 6-Benzyladenine
- Molecular formula
- (C12H13NO)2
- Molecular weight
- 187.24
Names & synonyms
71096-80-5(E)-1-(3,4-Dihydro-2H-pyran-2-yl)-N-phenylmethanimineNSC408191-(3,4-dihydro-2H-pyran-2-yl)-N-phenylmethanimineDTXSID30328628NSC-40819Aniline,4-dihydro-2H-pyran-2-ylmethylene)-, dimerNSC 408191-(3,4-dihydro-2H-pyran-2-yl)-N-phenyl-methanimineN-[(3,4-Dihydro-2H-pyran-2-yl)methylene]benzenamine dimer
Database identifiers
- CAS
71096-80-5- PubChem CID
- 412667
- DTXSID
DTXSID30328628
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 21.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 216
Chemistry & industry
Suppliers1 total
湖北玖天生物医药科技有限公司027-88013699 17354350817 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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