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1-(4-Bromo-3,5-dimethoxyphenyl)propan-1-ol

HCID 58432003
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Basic information

Standard SMILES
CCC(O)c1cc(OC)c(Br)c(OC)c1
InChIKey
SJCGVMGNOINXHP-UHFFFAOYSA-N
Molecular formula
C11H15BrO3
Average molar mass
275.14 g/mol

Names & identifiers

Preferred name
1-(4-Bromo-3,5-dimethoxyphenyl)propan-1-ol
IUPAC
1-(4-bromo-3,5-dimethoxyphenyl)propan-1-ol

Names & synonyms

1-(4-bromo-3,5-dimethoxyphenyl)propan-1-olSCHEMBL2388775SJCGVMGNOINXHP-UHFFFAOYSA-N

Database identifiers

PubChem CID
58432003

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
38.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
15
Formal charge
0
Complexity
175

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Related reactions

10 records
New reaction record
HRID 56584 reaction equation
HRID 56584As productuspto-grants-2016_09
HRID 56585 reaction equation
HRID 56585As reactantuspto-grants-2016_09
HRID 93343 reaction equation
HRID 93343As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 512683 reaction equation
HRID 512683As productuspto-grants-2015_08
HRID 512684 reaction equation
HRID 512684As reactantuspto-grants-2015_08
HRID 1121056 reaction equation
HRID 1121056As productTraining data from https://doi.org/10.1039/C8SC04228D (7/10)
HRID 1798653 reaction equation
HRID 1798653As productuspto-grants-2013_01
HRID 1798654 reaction equation
HRID 1798654As reactantuspto-grants-2013_01
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Compound notes

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