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Home Aminos 2-(aminomethyl)-3,4-dihydroquinazolin-4-one dihydrochloride

2-(aminomethyl)-3,4-dihydroquinazolin-4-one dihydrochloride

CAS No.:
1955498-69-7
Catalog Number:
AG01C4LN
Molecular Formula:
C9H11Cl2N3O
Molecular Weight:
248.1091
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Product Description
Catalog Number:
AG01C4LN
Chemical Name:
2-(aminomethyl)-3,4-dihydroquinazolin-4-one dihydrochloride
CAS Number:
1955498-69-7
Molecular Formula:
C9H11Cl2N3O
Molecular Weight:
248.1091
MDL Number:
MFCD29763169
IUPAC Name:
2-(aminomethyl)-3H-quinazolin-4-one;dihydrochloride
InChI:
InChI=1S/C9H9N3O.2ClH/c10-5-8-11-7-4-2-1-3-6(7)9(13)12-8;;/h1-4H,5,10H2,(H,11,12,13);2*1H
InChI Key:
JFITWZBSSYVVQN-UHFFFAOYSA-N
SMILES:
NCc1nc2ccccc2c(=O)[nH]1.Cl.Cl
Properties
Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.028g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
248.107g/mol
Monoisotopic Mass:
247.028g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
67.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties