Basic information
- CAS
151-00-8- Standard SMILES
CC(C)C=NO- InChIKey
SYJPAKDNFZLSMV-UHFFFAOYSA-N- Molecular formula
- C4H9NO
- Average molar mass
- 87.12 g/mol
- Monoisotopic mass
- 87.06841391
Names & identifiers
- Preferred name
- Propanal, 2-methyl-, oxime
- IUPAC
- N-(2-methylpropylidene)hydroxylamine
- English name
- isobutyraldehyde oxime
- Molecular formula
- C4H9NO
- Molecular weight
- 87.12
Names & synonyms
Propanal, 2-methyl-, oximeDTXSID0059742RefChem:868699DTXCID1034890N-(2-methylpropylidene)hydroxylamineISOBUTYRALDEHYDE, OXIME2-methylpropionaldehyde oximeSCHEMBL93703orb1221193orb1302441SCHEMBL4308872SCHEMBL7295921
Show more names
2-Methylpropanal oximeisobutyraldehyde oxime(E)-2-methylpropanal oxime(E)-isobutyraldehyde oxiMe2-Methyl-propionaldehyde oximeIsobutyraldehyde oxime - [I2624]ISOBUTYRALDEHYDE OXIME, 10 mM in DMSO
SCHEMBL7296060SCHEMBL8014325SCHEMBL8048363SCHEMBL13506331SCHEMBL27495640DB-319678F959620
Database identifiers
- CAS
151-00-8- PubChem CID
- 9023
- DTXSID
DTXSID0059742
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 32.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 49.5
Physicochemical properties
- Boiling point
- 160.97 °C · 160.97°C (rough estimate)
- Density
- 0.9906 · 0.9906 (rough estimate)
- refractive index
- 1.49 · 1.4900 (estimate)
- storage temp.
- 2 · 2-8°C, sealed storage, away from moisture
- pka
- 11.33 · 11.33±0.11(Predicted)
- Appearance
- Colorless to light yellow Liquid
- LogP
- 0.75 · 0.750 (est)
- FDA UNII
- 5 EW54CL2K7 · 5EW54CL2K7
- EPA Substance Registry System
- 2 · Propanal, 2-methyl-, oxime (151-00-8)
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 312 · H312-H301-H332
- Precautionary statements
- 264 · P264-P270-P301+P310-P321-P330-P405-P501-P280-P302+P352-P312-P322-P363-P501-P261-P271-P304+P340-P312
- 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
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- Hazard statements
- H312-H301-H332
- Precautionary statements
- P264-P270-P301+P310-P321-P330-P405-P501-P280-P302+P352-P312-P322-P363-P501-P261-P271-P304+P340-P312
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationPropanal, 2-methyl-, oxime: INACTIVE
Upstream & downstream products
Downstream products
Suppliers29 total
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Syntechem Co.,Ltd[email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
山东李比希生物医药科技有限公司17866677155 · [email protected]
南京诺利斯医药科技有限公司13901585132 · [email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
上海健超生物科技有限公司150-2103-5486 18017383231 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
Related reactions
2 records
Compound notes
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