Basic information
- CAS
5597-27-3- Standard SMILES
C=C1C(=O)C2CCC1C2- InChIKey
FNOOZJAPZFHNCW-UHFFFAOYSA-N- Molecular formula
- C8H10O
- Average molar mass
- 122.16 g/mol
- Monoisotopic mass
- 122.07316494
Overview
structure in first source
Names & identifiers
- Preferred name
- 3-Methylene-2-norbornanone
- IUPAC
- 3-methylidenebicyclo[2.2.1]heptan-2-one
- English name
- 3-Methylene-2-norbornanone
- Molecular formula
- C8H10O
- Molecular weight
- 122.16
Names & synonyms
3-Methylene-2-norbornanoneRefChem:5042155597-27-33-methylidenebicyclo[2.2.1]heptan-2-one3-Methylenenorbornan-2-one3-Methylenebicyclo[2.2.1]heptan-2-oneBicyclo[2.2.1]heptan-2-one, 3-methylene-2-Norbornanone, 3-methylene-DTXSID509713723-methylene-bicyclo[2,2,1]heptan-2-oneNSC91505EINECS 227-009-4
Show more names
3-methylene-2-norboranone3-Methylene-2-norbornanone>3-Methylene-2-norbornanone,90%3-Methylene-2-norbornanone,97%3-Methylene-2-norbornanone 97%
SCHEMBL646654CHEMBL364131NSC 91505NSC-91505AKOS025295471BS-533723-Methylenebicyclo[2.2.1]heptan-2-one #CS-0186844
Database identifiers
- CAS
5597-27-3- PubChem CID
- 96875
- DTXSID
DTXSID50971372- ChEMBL
CHEMBL364131
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 181
Physicochemical properties
- Boiling point
- 69 · 69-71 °C/11 mmHg (lit.)
- Density
- 0.997 g/mL · 0.997 g/mL at 25 °C (lit.)
- refractive index
- 20 · n20/D 1.493(lit.)
- Flash point
- 131 °F · 131 °F
- storage temp.
- 2 · 2-8°C, stored under nitrogen
- form
- clear liquid
- color
- Colorless to Yellow
- UNSPSC Code
- 12352100 · 12352100
- Symbol(GHS)
- 2 · GHS02
- Signal word
- Warning
- Hazard statements
- 226 · H226
- Precautionary statements
- 210 · P210-P233-P240-P241+P242+P243-P280-P303+P361+P353-P370+P378-P403+P235-P501
- Risk Statements
- 10 · 10
- Safety Statements
- 16 · 16
- RIDADR
- 1224 · UN 1224 3/PG 3
- WGK Germany
- 3 · 3
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
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesFlam. Liq. 3 (100%)
Safety data
- wgk
- 3
- ridadr
- UN 1224 3/PG 3
- hs_code
- 2914.29.5000
- risk_code
- 10
- Signal word
- Warning
- Symbol(GHS)
- GHS02
- safety_code
- 16
- hazard_class
- 3.2
- packing_group
- III
- Hazard statements
- H226
- Precautionary statements
- P210-P233-P240-P241+P242+P243-P280-P303+P361+P353-P370+P378-P403+P235-P501
Chemistry & industry
Applications
Uses3-Methylene-2-norbornanone can be used as a reactant to prepare:3-(2-(4-methoxyphenyl)-2-oxoethyl)bicyclo[2.2.1]heptan-2-one by reacting with 4-anisaldehyde in the presence of tetrabutylammonium decatungstate (TBADT) photocatalyst. 2-Aryl-3-methylene-endo-norbornanols by treating with corresponding aryl lithium reagents.
Suppliers37 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）
Related reactions
4 records
Compound notes
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