4-(Methoxymethoxy)-3-(3-methylbut-2-en-1-yl)benzaldehyde

HCID 14559752

Notes Reactions

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Basic information

CAS: 74021-58-2
Standard SMILES: COCOc1ccc(C=O)cc1CC=C(C)C
InChIKey: BWOFOKOAUKWKBC-UHFFFAOYSA-N
Molecular formula: C14H18O3
Average molar mass: 234.29 g/mol
Monoisotopic mass: 234.12559443

Names & identifiers

Preferred name: 4-(Methoxymethoxy)-3-(3-methylbut-2-en-1-yl)benzaldehyde
IUPAC: 4-(methoxymethoxy)-3-(3-methylbut-2-enyl)benzaldehyde

Names & synonyms

4-(Methoxymethoxy)-3-(3-methylbut-2-en-1-yl)benzaldehyde74021-58-2DTXSID80561669RefChem:289147DTXCID90512445SCHEMBL3303998BWOFOKOAUKWKBC-UHFFFAOYSA-N4-methoxymethyloxy-3-prenylbenzaldehyde4-methoxymethoxy-3-(3-methyl-2-butenyl)benzaldehyde

Database identifiers

CAS: 74021-58-2
PubChem CID: 14559752
DTXSID: DTXSID80561669
Nikkaji: J1.112.168C

Properties

Computed structural properties

XLogP: 3.2
Topological polar surface area: 35.5 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 6
Heavy atoms: 17
Formal charge: 0
Complexity: 256

Related reactions

5 records

New reaction record

HRID 140971As productTraining data from https://doi.org/10.1039/C8SC04228D (9/10)

HRID 1030697As productuspto-grants-1992_04

HRID 1030763As productuspto-grants-1992_04

HRID 2254212As productuspto-grants-1993_08

HRID 2254278As productuspto-grants-1993_08

Compound notes

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