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Home > Aldehydes > 143884-90-6
143884-90-6 | 1H-Pyrrole-2-carboxaldehyde, 5-(ethoxymethyl)-1-methyl-
CAS No: 143884-90-6 Catalog No: AG001IKF MDL No:
Product Description
Catalog Number:
AG001IKF
Chemical Name:
1H-Pyrrole-2-carboxaldehyde, 5-(ethoxymethyl)-1-methyl-
CAS Number:
143884-90-6
Molecular Formula:
C9H13NO2
Molecular Weight:
167.2050
IUPAC Name:
5-(ethoxymethyl)-1-methylpyrrole-2-carbaldehyde
InChI:
InChI=1S/C9H13NO2/c1-3-12-7-9-5-4-8(6-11)10(9)2/h4-6H,3,7H2,1-2H3
InChI Key:
XVCYOQRDQZQXLQ-UHFFFAOYSA-N
SMILES:
Cn1c(COCC)ccc1C=O
Properties
Complexity:
150
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.095g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
167.208g/mol
Monoisotopic Mass:
167.095g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
31.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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