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1380300-74-2 | N-(Azetidin-3-yl)pyrimidin-2-amine dihydrochloride
CAS No: 1380300-74-2 Catalog No: AG01F918 MDL No:MFCD22375729
Product Description
Catalog Number:
AG01F918
Chemical Name:
N-(Azetidin-3-yl)pyrimidin-2-amine dihydrochloride
CAS Number:
1380300-74-2
Molecular Formula:
C7H12Cl2N4
Molecular Weight:
223.1030
MDL Number:
MFCD22375729
IUPAC Name:
N-(azetidin-3-yl)pyrimidin-2-amine;dihydrochloride
InChI:
InChI=1S/C7H10N4.2ClH/c1-2-9-7(10-3-1)11-6-4-8-5-6;;/h1-3,6,8H,4-5H2,(H,9,10,11);2*1H
InChI Key:
NIYSIONKJIHCDD-UHFFFAOYSA-N
SMILES:
N1CC(C1)Nc1ncccn1.Cl.Cl
Properties
Complexity:
118
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.044g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
223.101g/mol
Monoisotopic Mass:
222.044g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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