200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 307553-49-7
307553-49-7 | 2-[4-(2,4-dinitrophenyl)piperazin-1-yl]pyrimidine
CAS No: 307553-49-7 Catalog No: AG00IT6R MDL No:MFCD01604350
Product Description
Catalog Number:
AG00IT6R
Chemical Name:
2-[4-(2,4-dinitrophenyl)piperazin-1-yl]pyrimidine
CAS Number:
307553-49-7
Molecular Formula:
C14H14N6O4
Molecular Weight:
330.2988
MDL Number:
MFCD01604350
IUPAC Name:
2-[4-(2,4-dinitrophenyl)piperazin-1-yl]pyrimidine
InChI:
InChI=1S/C14H14N6O4/c21-19(22)11-2-3-12(13(10-11)20(23)24)17-6-8-18(9-7-17)14-15-4-1-5-16-14/h1-5,10H,6-9H2
InChI Key:
JDIDJBQLWLLWRX-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1N1CCN(CC1)c1ncccn1)[N+](=O)[O-]
Properties
Complexity:
453
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
330.108g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
330.304g/mol
Monoisotopic Mass:
330.108g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
124A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.