CAS
935668-43-2 Purity
96%
935668-43-2 Purity
96%
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4-Butoxy-3-ethoxybenzaldehyde
CAS
93567-90-9
Catalog Number
ACM93567909
Category
Other Products
Molecular Weight
222.280
Molecular Formula
C13H18O3
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Specification
Synonyms
CBMicro_019076, 4-butoxy-3-ethoxybenzaldehyde, MolPort-000-466-195, ZINC01792315, ALBB-001156, STK346818, CID1580153, BIM-0019195.P001, A2572/0109632, 93567-90-9
IUPAC Name
4-butoxy-3-ethoxybenzaldehyde
Canonical SMILES
CCCCOC1=C(C=C(C=C1)C=O)OCC
InChI Key
GVCSYUPPGUVAPK-UHFFFAOYSA-N
Boiling Point
334.9ºC at 760mmHg
Flash Point
147.5ºC
Density
1.033g/cm³
Exact Mass
222.12600
H-Bond Acceptor
3
H-Bond Donor
0
What is the molecular formula of 4-Butoxy-3-ethoxybenzaldehyde?
The molecular formula of 4-Butoxy-3-ethoxybenzaldehyde is C13H18O3.
When was 4-Butoxy-3-Ethoxybenzaldehyde created and modified in PubChem?
4-Butoxy-3-Ethoxybenzaldehyde was created on July 11, 2005, and modified on December 30, 2023.
What are some synonyms for 4-Butoxy-3-Ethoxybenzaldehyde?
Some synonyms for 4-Butoxy-3-Ethoxybenzaldehyde include 93567-90-9, MFCD01922177, and 4-Butoxy-3-ethoxy-benzaldehyde.
What is the molecular weight of 4-Butoxy-3-Ethoxybenzaldehyde?
The molecular weight of 4-Butoxy-3-Ethoxybenzaldehyde is 222.28 g/mol.
What is the InChIKey of 4-Butoxy-3-Ethoxybenzaldehyde?
The InChIKey of 4-Butoxy-3-Ethoxybenzaldehyde is GVCSYUPPGUVAPK-UHFFFAOYSA-N.
How many hydrogen bond acceptor counts are there in 4-Butoxy-3-Ethoxybenzaldehyde?
There are 3 hydrogen bond acceptor counts in 4-Butoxy-3-Ethoxybenzaldehyde.
What is the topological polar surface area of 4-Butoxy-3-Ethoxybenzaldehyde?
The topological polar surface area of 4-Butoxy-3-Ethoxybenzaldehyde is 35.5 Ų.
Is 4-Butoxy-3-Ethoxybenzaldehyde considered canonicalized in PubChem?
Yes, 4-Butoxy-3-Ethoxybenzaldehyde is considered canonicalized in PubChem.
What is the exact mass of 4-Butoxy-3-Ethoxybenzaldehyde?
The exact mass of 4-Butoxy-3-Ethoxybenzaldehyde is 222.125594432 g/mol.
How many rotatable bond counts are there in 4-Butoxy-3-Ethoxybenzaldehyde?
There are 7 rotatable bond counts in 4-Butoxy-3-Ethoxybenzaldehyde.
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