Basic information
- CAS
85928-57-0- Standard SMILES
COc1ccc2c(c1)C(=O)C(Br)CC2- InChIKey
WHEBCCJXJLNMGZ-UHFFFAOYSA-N- Molecular formula
- C11H11BrO2
- Average molar mass
- 255.11 g/mol
- Monoisotopic mass
- 253.99424169
Names & identifiers
- Preferred name
- 2-Bromo-3,4-dihydro-7-methoxy-1(2H)-naphthalenone
- IUPAC
- 2-bromo-7-methoxy-3,4-dihydro-2H-naphthalen-1-one
- English name
- 2-Bromo-7-methoxy-3,4-dihydronaphthalen-1(2H)-one
- Molecular formula
- C11H11BrO2
- Molecular weight
- 255.11
Names & synonyms
2-Bromo-3,4-dihydro-7-methoxy-1(2H)-naphthalenoneRefChem:466190653-837-485928-57-02-BROMO-7-METHOXY-3,4-DIHYDRONAPHTHALEN-1(2H)-ONE2-Bromo-7-methoxy-1-tetralone2-bromo-7-methoxy-3,4-dihydro-2H-naphthalen-1-oneNSC2184541(2H)-Naphthalenone, 2-bromo-3,4-dihydro-7-methoxy-SCHEMBL3875408SCHEMBL30714800DTXSID70309895
Show more names
2-BroMo-3,4-dihydro-7-Methoxy-
AKOS017547747MB00611NSC-218454DB-313762EN300-35664712-Bromo-3,4-dihydro-7-methoxy-1 (2H)-naphthalenone2-Bromo-3,4-dihydro-7-methoxy-1(2 H)-naphthalenone2-bromo-7-methoxy-3,4-dihydro-1(2H)-naphthalenone
Database identifiers
- CAS
85928-57-0- PubChem CID
- 311906
- DTXSID
DTXSID70309895- EC Number
- 653-837-4
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 229
Physicochemical properties
- solubility
- Dichloromethane, Diethyl Ether, Ethyl Acetate
- form
- Solid
- color
- Yellow
- 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
Suppliers8 total
江苏艾康生物医药研发有限公司025-58851090 19370895928 · [email protected]
凯试（上海）科技有限公司021-50135380 · [email protected]
赛诺威（厦门）科技有限公司请加微信(同手机号)或QQ询价 13876246362 · [email protected]
凯试（上海）科技有限公司021-50135380 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
合肥瑞科昇生物科技有限公司0551-66336380 18956014586 · [email protected]
北京珐默兹医药科技有限公司15811073878 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
5 records
Compound notes
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