CAS
90109-14-1 Purity
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90109-14-1 Purity
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3-Bromo-4,5-diethoxybenzaldehyde
CAS
90109-64-1
Catalog Number
ACM90109641
Category
Other Products
Molecular Weight
273.123120 [g/mol]
Molecular Formula
C11H13BrO3
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Specification
Synonyms
3-bromo-4,5-diethoxybenzaldehyde, ZINC03886330, ALBB-001369, STK198701, CID2793423, T0520-5696, 90109-64-1
IUPAC Name
3-bromo-4,5-diethoxybenzaldehyde
InChI Key
YPBFTPYBXACRPN-UHFFFAOYSA-N
Boiling Point
341.6ºC at 760 mmHg
Flash Point
160.4ºC
Density
1.377g/cm³
Exact Mass
272.00500
H-Bond Acceptor
3
H-Bond Donor
0
What is the molecular formula of 3-Bromo-4,5-diethoxybenzaldehyde?
The molecular formula is C11H13BrO3.
What is the molecular weight of 3-Bromo-4,5-diethoxybenzaldehyde?
The molecular weight is 273.12 g/mol.
What is the IUPAC name of 3-Bromo-4,5-diethoxybenzaldehyde?
The IUPAC name is 3-bromo-4,5-diethoxybenzaldehyde.
What is the InChI of 3-Bromo-4,5-diethoxybenzaldehyde?
The InChI is InChI=1S/C11H13BrO3/c1-3-14-10-6-8(7-13)5-9(12)11(10)15-4-2/h5-7H,3-4H2,1-2H3.
What is the InChIKey of 3-Bromo-4,5-diethoxybenzaldehyde?
The InChIKey is YPBFTPYBXACRPN-UHFFFAOYSA-N.
What is the Canonical SMILES of 3-Bromo-4,5-diethoxybenzaldehyde?
The Canonical SMILES is CCOC1=C(C(=CC(=C1)C=O)Br)OCC.
What is the CAS number of 3-Bromo-4,5-diethoxybenzaldehyde?
The CAS number is 90109-64-1.
What is the XLogP3-AA value of 3-Bromo-4,5-diethoxybenzaldehyde?
The XLogP3-AA value is 2.8.
What is the topological polar surface area of 3-Bromo-4,5-diethoxybenzaldehyde?
The topological polar surface area is 35.5 Å2.
Is the compound canonicalized?
Yes, the compound is canonicalized according to PubChem.
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