Basic information
- CAS
30478-88-7- Standard SMILES
Oc1cc2ccccc2cc1Br- InChIKey
PQVIOPAWVAOHOA-UHFFFAOYSA-N- Molecular formula
- C10H7BrO
- Average molar mass
- 223.07 g/mol
- Monoisotopic mass
- 221.96803
Names & identifiers
- Preferred name
- 2-Naphthalenol, 3-bromo-
- IUPAC
- 3-bromonaphthalen-2-ol
- English name
- 3-Bromo-2-naphthol
- Molecular formula
- C10H7BrO
- Molecular weight
- 223.07
Names & synonyms
30478-88-72-Naphthalenol, 3-bromo-RefChem:477084626-985-23-Bromo-2-naphthol3-bromonaphthalen-2-olBromo-beta-naphthol2-NAPHTHOL, BROMO-3-Bromo-2-naphthalenolBrom-beta-naphtol [German]63980-30-3MFCD10000951
Show more names
3-Bromo-2-naphthol >3-bromo-2-naphthalenol3-Bromo-2-naphthol 99%2-NAPHTHALENOL, 3-BROMO- ISO 9001：2015 REACH
3-Brom-2-oxy-naphthalinAKOS005259239SY055576CS-0112709EN300-244700T70735Brom-beta-naphtolBromo-2-Naphthalenol
Database identifiers
- CAS
30478-88-7、63980-30-3- PubChem CID
- 45943
- DTXSID
DTXSID20213852- EC Number
- 626-985-2
- Nikkaji
- J852.072K
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 160
Experimental & physicochemical properties
SpringerMaterials Properties13C nuclear magnetic resonance spectrum
Physicochemical properties
- Melting point
- 82 °C · 82 °C
- Boiling point
- 313.7 · 313.7±15.0 °C(Predicted)
- Density
- 1.614 · 1.614±0.06 g/cm3(Predicted)
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- form
- powder to crystal
- pka
- 8.03 · 8.03±0.40(Predicted)
- color
- White to Light yellow
- InChI
- 1S/C10H7BrO/c11-9-5-7-3-1-2-4-8(7)6-10(9)12/h1-6,12H
- InChIKey
- PQVIOPAWVAOHOA-UHFFFAOYSA-N
- SMILES
- Oc1cc2ccccc2cc1Br
- CAS DataBase Reference
- 30478 · 30478-88-7
- UNSPSC Code
- 12352100 · 12352100
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
Danger
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 69 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- hs_code
- 2908.19.6000
- risk_code
- 37/38-41
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS07
- hazard_code
- Xi
- safety_code
- 26-39
- Storage Class
- 11 - Combustible Solids
- target organs
- Respiratory system
- Hazard statements
- H315-H318-H335
- Hazard Classifications
- Eye Dam. 1Skin Irrit. 2STOT SE 3
- Precautionary statements
- P280-P302+P352-P305+P351+P338+P310
Chemistry & industry
Applications
Uses3-Bromo-2-naphthol is an important organic compound with a wide range of applications in the pharmaceutical and chemical industries. It is commonly used in organic synthetic materials to prepare pharmaceutical products, ester compounds, resin compositions, curing products and stacking films; it serves as an important reagent and catalyst in a variety of chemical reactions.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers95 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]
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]
上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [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]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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