Basic information
- CAS
5111-66-0- Standard SMILES
COc1ccc2cc(O)ccc2c1- InChIKey
WWPKRXOOVICNJY-UHFFFAOYSA-N- Molecular formula
- C11H10O2
- Average molar mass
- 174.2 g/mol
- Monoisotopic mass
- 174.06807956
Names & identifiers
- Preferred name
- 6-Methoxy-2-naphthol
- IUPAC
- 6-methoxynaphthalen-2-ol
- English name
- 6-Methoxy-2-naphthol
- Molecular formula
- C11H10O2
- Molecular weight
- 174.2
Names & synonyms
6-Methoxy-2-naphthol6-methoxynaphthalen-2-ol5111-66-02-Methoxy-6-naphthol6-Methoxy-beta-naphthol6-Methoxy-2-hydroxynaphthaleneUNII-DL375UDR3ENaproxen impurity H [EP]DL375UDR3EBRL-10720Naproxen sodium impurity H [EP]Naproxen impurity H
Show more names
HydroxynerolinNaproxen EP IMpurity H6-methoxy-2-naphthalenol6-METHOXY-NAPHTHALEN-2-OL2-Naphthalenol, 6-methoxy-2-HYDROXY-6-METHOXYNAPHTHALENE6-Methoxynaphthalen-2-ol (Hydroxyne6-Methoxy-2-naphthol >=97.0% (HPLC)
NSC 149908NSC-149908DTXSID701991176-METHOXY-.BETA.-NAPHTHOLNAPROXEN IMPURITY H [EP IMPURITY]NAPROXEN SODIUM IMPURITY H [EP IMPURITY]NAPROXEN IMPURITY H (EP IMPURITY)NAPROXEN SODIUM IMPURITY H (EP IMPURITY)
Database identifiers
- CAS
5111-66-0- PubChem CID
- 288634
- DTXSID
DTXSID70199117- UNII
- DL375UDR3E
- EC Number
- 629-038-1
- Nikkaji
- J540.192E
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 169
Physicochemical properties
- Melting point
- 148 · 148-152 °C
- Boiling point
- 336.7 · 336.7±15.0 °C(Predicted)
- Density
- 1.193 · 1.193±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- solubility
- Chloroform (Slightly), Methanol (Slightly)
- form
- Solid
- pka
- 9.76 · 9.76±0.40(Predicted)
- color
- Off-White to Light Brown
- BRN
- 2043873 · 2043873
- Stability
- Light Sensitive
- InChI
- InChI=1S/C11H10O2/c1-13-11-5-3-8-6-10(12)4-2-9(8)7-11/h2-7,12H,1H3
- InChIKey
- WWPKRXOOVICNJY-UHFFFAOYSA-N
- SMILES
- C1=C2C(C=C(OC)C=C2)=CC=C1O
- CAS DataBase Reference
- 5111 · 5111-66-0(CAS DataBase Reference)
- FDA UNII
- 375 UDR3E · DL375UDR3E
- UNSPSC Code
- 12352200 · 12352200
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- F
- 8-9-23
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- hs_code
- 2909500090
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36-37/39
- Storage Class
- 11 - Combustible Solids
- target organs
- Respiratory system
- Hazard statements
- H315-H319-H335
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- Precautionary statements
- P305+P351+P338
Chemistry & industry
Applications
Uses6-Methoxy-2-naphthol is a reactant in the development of sirtuin inhibitors from pyrazolone and isoxazol-5-one cambinol analogs.
Upstream & downstream products
Upstream raw materials
Suppliers95 total
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
上海策嵘生物科技有限公司[email protected]
艾吉析科技（上海）有限公司17717235263 · [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]
怀化元研达生物技术有限责任公司18711085600 · [email protected]
广州隽沐生物科技股份有限公司020-36607679; 13502246435 · [email protected]
Related reactions
33 records
Compound notes
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