Name: Name:1-[(4-chloro-3-nitrophenyl)methyl]-1,2,3,4-tetrahydropyrimidine-2,4-dione
Brand: Angene
SKU: AG01A2F1
Rating: 90 (10 reviews)

1-[(4-chloro-3-nitrophenyl)methyl]-1,2,3,4-tetrahydropyrimidine-2,4-dione

CAS No.:

1097789-53-1

Catalog Number:

AG01A2F1

Molecular Formula:

C11H8ClN3O4

Molecular Weight:

281.6519

Catalog Number:

AG01A2F1

Chemical Name:

1-[(4-chloro-3-nitrophenyl)methyl]-1,2,3,4-tetrahydropyrimidine-2,4-dione

CAS Number:

1097789-53-1

Molecular Formula:

C11H8ClN3O4

Molecular Weight:

281.6519

MDL Number:

MFCD12543547

IUPAC Name:

1-[(4-chloro-3-nitrophenyl)methyl]pyrimidine-2,4-dione

InChI:

InChI=1S/C11H8ClN3O4/c12-8-2-1-7(5-9(8)15(18)19)6-14-4-3-10(16)13-11(14)17/h1-5H,6H2,(H,13,16,17)

InChI Key:

PIJQFTGOWJWBBU-UHFFFAOYSA-N

SMILES:

[O-][N+](=O)c1cc(ccc1Cl)Cn1ccc(=O)[nH]c1=O

Complexity:

434

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

281.02g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

281.652g/mol

Monoisotopic Mass:

281.02g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

95.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2