Basic information
- CAS
40338-24-7- Standard SMILES
NC(=O)NN=C1CCCCCCC1- InChIKey
VVZRTXGIBUIDGP-UHFFFAOYSA-N- Molecular formula
- C9H17N3O
- Average molar mass
- 183.25 g/mol
- Monoisotopic mass
- 183.13716216
Names & identifiers
- Preferred name
- Cyclooctanone semicarbazone
- IUPAC
- (cyclooctylideneamino)urea
- English name
- (cyclooctylideneamino)urea
- Molecular formula
- C9H17N3O
- Molecular weight
- 183.25078
Names & synonyms
CYCLOOCTANONE SEMICARBAZONERefChem:580899653-601-0ST5054736540338-24-7cyclooctanone-semicarbazoneDTXSID70391679VVZRTXGIBUIDGP-UHFFFAOYSA-NAKOS008939506amino-N-(cyclooctylideneazamethyl)amide2-Cyclooctylidenehydrazine-1-carboxamide(cyclooctylideneamino)urea
Database identifiers
- CAS
40338-24-7- PubChem CID
- 3348066
- DTXSID
DTXSID70391679- EC Number
- 653-601-0
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 67.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 191
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers1 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
Related reactions
1 records
Compound notes
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