Methyl 3-hydroxy-2-naphthoate

HCID 70163
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Basic information

CAS
883-99-8
Standard SMILES
COC(=O)c1cc2ccccc2cc1O
InChIKey
YVVBECLPRBAATK-UHFFFAOYSA-N
Molecular formula
C12H10O3
Average molar mass
202.21 g/mol
Monoisotopic mass
202.06299418

Names & identifiers

Preferred name
Methyl 3-hydroxy-2-naphthoate
IUPAC
methyl 3-hydroxynaphthalene-2-carboxylate
English name
Methyl 3-hydroxy-2-naphthoate
Molecular formula
C12H10O3
Molecular weight
202.21

Names & synonyms

Methyl 3-hydroxy-2-naphthoate883-99-82-Naphthalenecarboxylic acid, 3-hydroxy-, methyl ester3-HYDROXY-2-NAPHTHOIC ACID METHYL ESTER2-Hydroxy-3-naphthoic acid methyl esterMethyl 2-hydroxy-3-naphthoateMethyl 3-hydroxy-2-naphthalenecarboxylate2-Naphthoic acid, 3-hydroxy-, methyl esterQCA37S018NEINECS 212-936-9NSC 25175NSC-25175
Show more names
METHYL B-HYDROXYNAPHTHOATEMethyl hydroxy-2-naphthoateMethyl-3-hydroxy-2-naphthoatMETHYL BETA-HYDROXYNAPHTHOATEMethyl3-Hydroxy-2-naphthoate>Methyl 3-hydroxy-2-naphthoate, 98+%beta-Hydroxynaphthoic acid methyl ester
3-carbomethoxy-2-naphthol3-(METHOXYCARBONYL)-2-NAPHTHOL3-Hydroxy-2-naphthalenecarboxylic acid methyl esterAI3-30205DTXSID8061260methyl 2-hydroxynaphthalene-3-carboxylateMETHYL 2-HYDROXY-3-NAPHTHOIC ACID2-HYDROXYNAPHTHALENE-3-CARBOXYLIC ACID METHYL ESTER

Database identifiers

CAS
883-99-8
PubChem CID
70163
DTXSID
DTXSID8061260
UNII
QCA37S018N
EC Number
212-936-9
Nikkaji
J131.974D

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
46.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
15

Experimental & physicochemical properties

SpringerMaterials Properties13C nuclear magnetic resonance spectrum

Physicochemical properties

Melting point
73 · 73-75 °C (lit.)
Boiling point
205 · 205-207 °C (lit.)
Density
1.1868 · 1.1868 (rough estimate)
refractive index
1.544 · 1.5440 (estimate)
Flash point
205 · 205-207°C/160mm
storage temp.
Inert atmosphere,Room Temperature

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 44 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory InformationChemical: 2-Naphthalenecarboxylic acid, 3-hydroxy-, methyl ester
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

F
9-23
PPE
dust mask type N95 (US), Eyeshields, Gloves
wgk
2
tsca
TSCA listed
hs_code
2918.29.7500
risk_code
36/37/38

Chemistry & industry

Uses & manufacturing

General Manufacturing Information2-Naphthalenecarboxylic acid, 3-hydroxy-, methyl ester: INACTIVE
Applications · 3 items

UsesMethyl 3-hydroxy-2-naphthoic acid is a carboxylic acid ester organic compound used in organic synthesis and experimental research.

UsesMethyl 3-hydroxy-2-naphthoate undergoes asymmetric oxidative coupling using mono-N-alkylated octahydrobinaphthyl-2,2′-diamine chiral ligands.

General DescriptionMethyl 3-hydroxy-2-naphthoate undergoes asymmetric oxidative coupling using mono-N-alkylated octahydrobinaphthyl-2,2′-diamine chiral ligands.

Upstream & downstream products

Suppliers100 total

湖北瑞凯兴科技股份有限公司0086-13795397680
国药集团化学试剂有限公司86-21-63210123 · [email protected]
常州帝通化工有限公司+86-0519-88298848 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]

Related reactions

16 records
New reaction record

Compound notes

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