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Home > Aldehydes > 1955518-33-8
1955518-33-8 | 2,4-diaminopyrimidine-5-carbaldehyde hydrochloride
CAS No: 1955518-33-8 Catalog No: AG01C4QS MDL No:MFCD29763208
Product Description
Catalog Number:
AG01C4QS
Chemical Name:
2,4-diaminopyrimidine-5-carbaldehyde hydrochloride
CAS Number:
1955518-33-8
Molecular Formula:
C5H7ClN4O
Molecular Weight:
174.5883
MDL Number:
MFCD29763208
IUPAC Name:
2,4-diaminopyrimidine-5-carbaldehyde;hydrochloride
InChI:
InChI=1S/C5H6N4O.ClH/c6-4-3(2-10)1-8-5(7)9-4;/h1-2H,(H4,6,7,8,9);1H
InChI Key:
JRDNZHQVDVWHLW-UHFFFAOYSA-N
SMILES:
O=Cc1cnc(nc1N)N.Cl
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.031g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
174.588g/mol
Monoisotopic Mass:
174.031g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
94.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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