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2-(4-Methoxyphenyl)naphthalene

HCID 11149014
NotesReactions
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
59115-45-6
Standard SMILES
COc1ccc(-c2ccc3ccccc3c2)cc1
InChIKey
HMJIYPQPQDOHRP-UHFFFAOYSA-N
Molecular formula
C17H14O
Average molar mass
234.29 g/mol
Monoisotopic mass
234.10446507

Names & identifiers

Preferred name
2-(4-Methoxyphenyl)naphthalene
IUPAC
2-(4-methoxyphenyl)naphthalene
English name
Anisole, p-2-naphthyl- (6CI,7CI)
Molecular formula
C17H14O
Molecular weight
234.29

Names & synonyms

2-(4-methoxyphenyl)naphthalene59115-45-6DTXSID20456964RefChem:252574DTXCID10407783Anisole,p-2-naphthyl-SCHEMBL1896522SCHEMBL5887550HMJIYPQPQDOHRP-UHFFFAOYSA-NHS-4267Anisole, p-2-naphthyl- (6CI,7CI)Naphthalene, 2-(4-methoxyphenyl)-

Database identifiers

CAS
59115-45-6
PubChem CID
11149014
DTXSID
DTXSID20456964
Nikkaji
J1.784.351F

Properties

Computed structural properties

XLogP
4.8
Topological polar surface area
9.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
2
Heavy atoms
18
Formal charge
0
Complexity
254

Physicochemical properties

Melting point
135 · 135-137℃ (ethanol )

Chemistry & industry

Suppliers2 total

杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
上海遐瑞医药科技有限公司+86 21 61551611

Related reactions

56 records
New reaction record
HRID 134179 reaction equation
HRID 134179As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 201303 reaction equation
HRID 201303As productTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 895170 reaction equation
HRID 895170As productuspto-grants-2005_07
HRID 895174 reaction equation
HRID 895174As reactantuspto-grants-2005_07
HRID 1494880 reaction equation
HRID 1494880As productNiCOlit
HRID 1494923 reaction equation
HRID 1494923As productNiCOlit
HRID 1494924 reaction equation
HRID 1494924As productNiCOlit
HRID 1494949 reaction equation
HRID 1494949As productNiCOlit
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Compound notes

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