1-bromo-4-methoxybenzene;chromium;formaldehyde

C10H13BrCrO4 — CID 173400891

IUPAC1-bromo-4-methoxybenzene;chromium;formaldehyde
SMILESC=O.C=O.C=O.COc1ccc(Br)cc1.[Cr]
InChIInChI=1S/C7H7BrO.3CH2O.Cr/c1-9-7-4-2-6(8)3-5-7;3*1-2;/h2-5H,1H3;3*1H2;
InChIKeyLSESJBGMIYBUJX-UHFFFAOYSA-N
MW329.11 g/mol
LogP1.90
Rot. Bonds1

About 1-bromo-4-methoxybenzene;chromium;formaldehyde

1-bromo-4-methoxybenzene;chromium;formaldehyde (PubChem CID 173400891) has the molecular formula C10H13BrCrO4 and a molecular weight of 329.11 g/mol. Its IUPAC name is 1-bromo-4-methoxybenzene;chromium;formaldehyde.

Molecular Properties

Compound Name1-bromo-4-methoxybenzene;chromium;formaldehyde
PubChem CID173400891
Molecular FormulaC10H13BrCrO4
Molecular Weight329.11 g/mol
Exact Mass327.94
IUPAC Name1-bromo-4-methoxybenzene;chromium;formaldehyde
SMILESC=O.C=O.C=O.COc1ccc(Br)cc1.[Cr]
InChIInChI=1S/C7H7BrO.3CH2O.Cr/c1-9-7-4-2-6(8)3-5-7;3*1-2;/h2-5H,1H3;3*1H2;
InChIKeyLSESJBGMIYBUJX-UHFFFAOYSA-N
XLogP1.90
TPSA60.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.11
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

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lithium;1-bromo-4-methoxybenzene;butane
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anisole;1-bromo-4-(4-bromophenyl)benzene
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(1S,2R)-1-(4-bromophenyl)-2-(4-methoxyphenyl)but-3-en-1-ol
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1-bromo-4-[1-(4-methoxyphenyl)but-3-enyl]benzene
CID 11255568
1-bromo-4-[(1R,2S)-1-ethyl-2-(4-methoxyphenyl)butyl]benzene
CID 125465303
1-bromo-4-[(E)-2-(4-methoxyphenyl)-1,2-diphenylethenyl]benzene
CID 132514241
(4-bromophenyl)sulfonyl-(4-methoxyphenyl)azanide
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N-(4-bromophenyl)-4-[(4-methoxybenzoyl)amino]benzamide
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5-bromo-2-(4-methoxyanilino)cyclohepta-2,4,6-trien-1-one
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Frequently Asked Questions

What is the IUPAC name of 1-bromo-4-methoxybenzene;chromium;formaldehyde?
The IUPAC name of 1-bromo-4-methoxybenzene;chromium;formaldehyde (CID 173400891) is 1-bromo-4-methoxybenzene;chromium;formaldehyde.
What is the SMILES notation for 1-bromo-4-methoxybenzene;chromium;formaldehyde?
The canonical SMILES for 1-bromo-4-methoxybenzene;chromium;formaldehyde is C=O.C=O.C=O.COc1ccc(Br)cc1.[Cr].
What is the InChIKey of 1-bromo-4-methoxybenzene;chromium;formaldehyde?
The InChIKey is LSESJBGMIYBUJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7BrO.3CH2O.Cr/c1-9-7-4-2-6(8)3-5-7;3*1-2;/h2-5H,1H3;3*1H2;.
What are the key properties of 1-bromo-4-methoxybenzene;chromium;formaldehyde?
1-bromo-4-methoxybenzene;chromium;formaldehyde has a molecular weight of 329.11 g/mol, XLogP of 1.90, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-4-methoxybenzene;chromium;formaldehyde is sourced from PubChem (CID 173400891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).