Basic information
- Standard SMILES
O/N=C/c1c2ccccc2cc2ccccc12- InChIKey
HLGMTCSSRBPNOQ-MHWRWJLKSA-N- Molecular formula
- C15H11NO
- Average molar mass
- 221.25 g/mol
Names & identifiers
- Preferred name
- 9-Anthraldehyde, oxime
- IUPAC
- (NE)-N-(anthracen-9-ylmethylidene)hydroxylamine
- English name
- (E)-9-Anthracenecarbaldehyde oxime
- Molecular formula
- C15H11NO
- Molecular weight
- 221.25
Names & synonyms
9-Anthraldehyde oxime9-Anthraldehyde, oxime(E)-N-[(ANTHRACEN-9-YL)METHYLIDENE]HYDROXYLAMINEMFCD00012252MS-89481942-19-4anthracene-9-carbaldehyde oxime9-Anthraldoxime(NE)-N-(anthracen-9-ylmethylidene)hydroxylamine9-anthraldehyde oxime, 98%9-anthryl(hydroxyimino)methaneSCHEMBL17988287
Show more names
syn-9-Anthraldoxime(E)-9-Anthraldehyde oxime(E)-9-Anthracenecarbaldehyde oxime
HLGMTCSSRBPNOQ-MHWRWJLKSA-NNSC26820NSC-26820(9E)-anthracene-9-carbaldehyde oximeAKOS000304433FA69866ST510139319-Anthraldehyde oxime, predominantly syn, 99%
Database identifiers
- CAS
1942-19-4- Nikkaji
- J422.006D、J80.349I
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 32.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 267
Physicochemical properties
- Melting point
- 157 · 157-160 °C
- Boiling point
- 424.571 · 424.571±14.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.161 · 1.161±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 10.681 · 10.681±0.30(predicted)
Chemistry & industry
Suppliers2 total
苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
南兴化工（江苏）有限公司0512-66387035 18662433356 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Linked notes
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