4-hydroxy-3-methoxy-5-[(5-phenyltetrazol-2-yl)methyl]benzaldehyde

CAS: 104065-29-4

Molecular Formula	`C16H14N4O3`
Molecular Weight	310.31 g/mol
LogP	2.5
Topological Polar Surface Area	90.1 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	5
Exact Mass	310.1066
Heavy Atoms	23
Complexity	392.0

Chemical Identifiers

CAS Number	104065-29-4
SMILES	`COC1=CC(=CC(=C1O)CN2N=C(N=N2)C3=CC=CC=C3)C=O`
InChIKey	`GDYBDKGSGCSFEA-UHFFFAOYSA-N`

📖 Product Overview

4-hydroxy-3-methoxy-5-[(5-phenyltetrazol-2-yl)methyl]benzaldehyde (CAS: 104065-29-4) is a chemical compound with molecular formula C16H14N4O3 and molecular weight 310.31 g/mol. Its IUPAC systematic name is 4-hydroxy-3-methoxy-5-[(5-phenyltetrazol-2-yl)methyl]benzaldehyde. LogP 2.5 Topological Polar Surface Area 90.1 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 6 Rotatable Bonds 5 Exact Mass 310.1066 Heavy Atoms 23 Complexity 392.0 InChI Key: GDYBDKGSGCSFEA-UHFFFAOYSA-N. SMILES: COC1=CC(=CC(=C1O)CN2N=C(N=N2)C3=CC=CC=C3)C=O.

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