200,000+ products from a single source!
sales@angenechem.com
Home > Aldehydes > 2059935-24-7
2059935-24-7 | 4-(5-methyl-3-oxopiperazin-2-yl)benzaldehyde
CAS No: 2059935-24-7 Catalog No: AG01BQR0 MDL No:MFCD30501822
Product Description
Catalog Number:
AG01BQR0
Chemical Name:
4-(5-methyl-3-oxopiperazin-2-yl)benzaldehyde
CAS Number:
2059935-24-7
Molecular Formula:
C12H14N2O2
Molecular Weight:
218.2518
MDL Number:
MFCD30501822
IUPAC Name:
4-(5-methyl-3-oxopiperazin-2-yl)benzaldehyde
InChI:
InChI=1S/C12H14N2O2/c1-8-6-13-11(12(16)14-8)10-4-2-9(7-15)3-5-10/h2-5,7-8,11,13H,6H2,1H3,(H,14,16)
InChI Key:
KHCBYRCXFMTEID-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)C1NCC(NC1=O)C
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.106g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
218.256g/mol
Monoisotopic Mass:
218.106g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
Related Products
© 2019 Angene International Limited. All rights Reserved.