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Basic information
- CAS
132095-54-6- Standard SMILES
O=C1CCc2ccc(Br)cc2C1- InChIKey
NCTYMQMYDHAKCE-UHFFFAOYSA-N- Molecular formula
- C10H9BrO
- Average molar mass
- 225.08 g/mol
- Monoisotopic mass
- 223.98368
Names & identifiers
- Preferred name
- 7-Bromo-2-tetralone
- IUPAC
- 7-bromo-3,4-dihydro-1H-naphthalen-2-one
- English name
- 7-Bromo-2-tetralone
- Molecular formula
- C10H9BrO
- Molecular weight
- 225.08
Names & synonyms
7-BROMO-2-TETRALONE132095-54-6DTXSID50395115RefChem:310412DTXCID103459747-bromo-3,4-dihydro-1H-naphthalen-2-one7-bromo-3,4-dihydronaphthalen-2(1H)-one2(1H)-Naphthalenone, 7-bromo-3,4-dihydro-7-bromo-1,2,3,4-tetrahydronaphthalen-2-oneMFCD040384867-bromotetralin-2-oneSCHEMBL415637
Show more names
7-bromo-3,4-dihydro-1h-2-naphthone7-broMo-3,4-dihydronaphthalen-2-one7-Bromo-3,4-dihydro-1H-phthalen-2-one
NCTYMQMYDHAKCE-UHFFFAOYSA-NCS-B0104AKOS015835919AB17100AS-65228SY008088DB-029351EN300-379516
Database identifiers
- CAS
132095-54-6- PubChem CID
- 3691574
- DTXSID
DTXSID50395115- EC Number
- 988-015-7
Properties
Computed structural propertiesFilling in
- XLogP
- 2.3
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 190
Physicochemical properties
- Melting point
- 72 · 72-74 °C
- Boiling point
- 319.2 · 319.2±42.0 °C(Predicted)
- Density
- 1.511 · 1.511±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C, · -20°C, stored under nitrogen
- Appearance
- Off-white to yellow Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
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]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
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)
Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Suppliers77 total
上海康恩博医药科技有限公司（科小研试剂）400-1388-521 17510465506 · [email protected]
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
Hangzhou Collab Medicine Co.,Ltd.+86-15936229464 · [email protected]
武汉英诺医药科技有限公司+86-027-59232304 15387063101 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
欧利希（湖北）医药科技有限公司17316404525 17316404525 · [email protected]
上海相辉医药科技有限公司13761987713; 13761987713 · [email protected]
上海景颜化工科技有限公司13817811078 · [email protected]
Pure Chemistry Scientific Inc.001-857-928-2050 or 1-888-588-9418 · [email protected]
西安瑞康医药技术有限公司(0)18629586220 +86-029-88499520 · [email protected]
Related reactions
31 records
Compound notes
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