200,000+ products from a single source!
sales@angenechem.com
Home > Aldehydes > 210115-39-2
210115-39-2 | Benzaldehyde, 4-(4-pyrimidinyl)-
CAS No: 210115-39-2 Catalog No: AG002KKW MDL No:
Product Description
Catalog Number:
AG002KKW
Chemical Name:
Benzaldehyde, 4-(4-pyrimidinyl)-
CAS Number:
210115-39-2
Molecular Formula:
C11H8N2O
Molecular Weight:
184.1940
IUPAC Name:
4-pyrimidin-4-ylbenzaldehyde
InChI:
InChI=1S/C11H8N2O/c14-7-9-1-3-10(4-2-9)11-5-6-12-8-13-11/h1-8H
InChI Key:
ZZDNILJULVAAAS-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)c1ccncn1
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.064g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.198g/mol
Monoisotopic Mass:
184.064g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.