200,000+ products from a single source!
sales@angenechem.com
29813-44-3 | 1H-Pyrrole-2-carboxaldehyde, 5-(hydroxymethyl)-1-methyl-
CAS No: 29813-44-3 Catalog No: AG007KAR MDL No:MFCD12923805
Product Description
Catalog Number:
AG007KAR
Chemical Name:
1H-Pyrrole-2-carboxaldehyde, 5-(hydroxymethyl)-1-methyl-
CAS Number:
29813-44-3
Molecular Formula:
C7H9NO2
Molecular Weight:
139.1519
MDL Number:
MFCD12923805
IUPAC Name:
5-(hydroxymethyl)-1-methylpyrrole-2-carbaldehyde
InChI:
InChI=1S/C7H9NO2/c1-8-6(4-9)2-3-7(8)5-10/h2-4,10H,5H2,1H3
InChI Key:
NCAZZSQBALIIQM-UHFFFAOYSA-N
SMILES:
OCc1ccc(n1C)C=O
Properties
Complexity:
127
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
139.063g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
139.154g/mol
Monoisotopic Mass:
139.063g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.