Basic information
- CAS
38167-88-3- Standard SMILES
CCOC(=O)C1CCCCC(=O)N1- InChIKey
YPXYGVWLLYUOEB-UHFFFAOYSA-N- Molecular formula
- C9H15NO3
- Average molar mass
- 185.22 g/mol
Names & identifiers
- Preferred name
- Ethyl 7-oxoazepane-2-carboxylate
- IUPAC
- ethyl 7-oxoazepane-2-carboxylate
- English name
- ethyl 7-oxoazepane-2-carboxylate
- Molecular formula
- C9H15NO3
- Molecular weight
- 185.22
Names & synonyms
ethyl 7-oxoazepane-2-carboxylate38167-88-3RefChem:596037823-820-8SCHEMBL3066907ethyl7-oxoazepane-2-carboxylateYPXYGVWLLYUOEB-UHFFFAOYSA-NNBA16788AKOS033662373NCGC00465784-01DB-2975907-oxo-azepane-2-carboxylic acid ethyl ester
Show more names
1H-Azepine-2-carboxylic acid, hexahydro-7-oxo-, ethyl ester
EN300-188741Z1509144164
Database identifiers
- CAS
38167-88-3- PubChem CID
- 12371765
- EC Number
- 823-820-8
- Nikkaji
- J1.223.690E
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 203
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335-H302
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification 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
- H315-H319-H335-H302
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers2 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]
Related reactions
1 records
Compound notes
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