CAS
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3-Methoxy-4-(2-propynyloxy)benzaldehyde
Catalog Number
ACMA00002205
Category
Ethers
Molecular Weight
190.20
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Specification
Hazard Statements
H302
RIDADR
UN 2811 6.1 / PGIII
Symbol
GHS07
What is the molecular formula of the compound?
The molecular formula of the compound is C11H10O3.
What is the molecular weight of the compound?
The molecular weight of the compound is 190.19 g/mol.
What is the IUPAC name of the compound?
The IUPAC name of the compound is 3-methoxy-4-prop-2-ynoxybenzaldehyde.
What is the InChI of the compound?
The InChI of the compound is InChI=1S/C11H10O3/c1-3-6-14-10-5-4-9(8-12)7-11(10)13-2/h1,4-5,7-8H,6H2,2H3.
What is the InChIKey of the compound?
The InChIKey of the compound is PKPPALIWMCCRFK-UHFFFAOYSA-N.
What is the canonical SMILES of the compound?
The canonical SMILES of the compound is COC1=C(C=CC(=C1)C=O)OCC#C.
What is the CAS number of the compound?
The CAS number of the compound is 5651-83-2.
How many hydrogen bond donor counts does the compound have?
The compound has 0 hydrogen bond donor counts.
How many hydrogen bond acceptor counts does the compound have?
The compound has 3 hydrogen bond acceptor counts.
How many rotatable bond counts does the compound have?
The compound has 4 rotatable bond counts.
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