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o-(Benzyloxy)anisole

HCID 70041
NotesReactions
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
835-79-0
Standard SMILES
COc1ccccc1OCc1ccccc1
InChIKey
MNELLQACUSWKSP-UHFFFAOYSA-N
Molecular formula
C14H14O2
Average molar mass
214.26 g/mol
Monoisotopic mass
214.09937969

Names & identifiers

Preferred name
o-(Benzyloxy)anisole
IUPAC
1-methoxy-2-phenylmethoxybenzene
English name
o-(benzyloxy)anisole
Molecular formula
C14H14O2
Molecular weight
214.25976

Names & synonyms

1-(benzyloxy)-2-methoxybenzene835-79-0o-(Benzyloxy)anisole1-methoxy-2-(phenylmethoxy)benzeneBenzene, 1-methoxy-2-(phenylmethoxy)-NSC-16710NSC-779701-methoxy-2-phenylmethoxybenzeneNSC16710EINECS 212-645-7NT7RH7KLX4NCIOpen2_004747
Show more names
Pyrocaine
SCHEMBL182637SCHEMBL339374SCHEMBL791853SCHEMBL1119402SCHEMBL2093962SCHEMBL3767201SCHEMBL5547846SCHEMBL12015269

Database identifiers

CAS
835-79-0
PubChem CID
70041
DTXSID
DTXSID10232411
UNII
NT7RH7KLX4
EC Number
212-645-7
Nikkaji
J195.108D

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
18.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
16
Formal charge
0
Complexity
187

Chemistry & industry

Suppliers6 total

苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
江苏艾康生物医药研发有限公司025-025-66113011 15955137747 · [email protected]
南兴化工(江苏)有限公司0512-66387035 18662433356 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
Guangzhou CATO Research Chemicals Inc.+86-020-81960175-617 18520203721 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]

Related reactions

2 records
New reaction record
HRID 91401 reaction equation
HRID 91401As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 937986 reaction equation
HRID 937986As reactantValidation data from https://doi.org/10.1039/C8SC04228D

Compound notes

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