Basic information
- CAS
5452-73-3- Standard SMILES
COC(=O)C1CCCCCCC1=O- InChIKey
FAADEEISKNEKDP-UHFFFAOYSA-N- Molecular formula
- C10H16O3
- Average molar mass
- 184.23 g/mol
- Monoisotopic mass
- 184.10994437
Names & identifiers
- Preferred name
- Methyl 2-oxocyclooctane-1-carboxylate
- IUPAC
- methyl 2-oxocyclooctane-1-carboxylate
- English name
- methyl 2-oxocyclooctane-1-carboxylate
- Molecular formula
- C10H16O3
- Molecular weight
- 0
Names & synonyms
5452-73-3methyl 2-oxocyclooctane-1-carboxylatemethyl 2-oxocyclooctanecarboxylateMFCD194412072-Oxo-1-cyclooctanecarboxylate methyl esterCyclooctanecarboxylic acid, 2-oxo-, methyl esterNSC18982ghl.PD_Mitscher_leg0.27SCHEMBL3767660methyl2-oxocyclooctanecarboxylateDTXSID40280884FAADEEISKNEKDP-UHFFFAOYSA-N
Show more names
2-(methoxycarbony)cyclooctanone
NSC-18982AKOS024257378AB76311AS-61647DB-087337EN300-3050956
Database identifiers
- CAS
5452-73-3- PubChem CID
- 227411
- DTXSID
DTXSID40280884- Nikkaji
- J1.257.587D
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 198
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Suppliers14 total
南京世洲生物科技有限公司025-025-85560043 17301488900 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
上海安米克化学品有限公司微信 17321281695 18019252918 · [email protected]
烟台正信新材料科技有限公司13854547682 13854547682 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
上海敏寒医药科技有限公司17612188245 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]
成都同创源医药科技有限公司028-83379370 13880556291 · [email protected]
上海平果医药科技有限公司021-20432229 · [email protected]
上海万千化工有限公司18796480002 18796480002 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
陕西缔都医药化工有限公司+86-29-87569266 +86-17392581500 · [email protected]
南京世洲生物科技有限公司025-85560043 13675144456 · [email protected]
北京珐默兹医药科技有限公司15811073878 · [email protected]
Related reactions
2 records
Compound notes
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