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1384264-47-4 | Pyrimidine, 4-(3-azetidinyl)-, hydrochloride (1:2)
CAS No: 1384264-47-4 Catalog No: AG00194K MDL No:MFCD22573701
Product Description
Catalog Number:
AG00194K
Chemical Name:
Pyrimidine, 4-(3-azetidinyl)-, hydrochloride (1:2)
CAS Number:
1384264-47-4
Molecular Formula:
C7H11Cl2N3
Molecular Weight:
208.0883
MDL Number:
MFCD22573701
IUPAC Name:
4-(azetidin-3-yl)pyrimidine;dihydrochloride
InChI:
InChI=1S/C7H9N3.2ClH/c1-2-8-5-10-7(1)6-3-9-4-6;;/h1-2,5-6,9H,3-4H2;2*1H
InChI Key:
HSLRLTHHIIOLOD-UHFFFAOYSA-N
SMILES:
N1CC(C1)c1ccncn1.Cl.Cl
Properties
Complexity:
111
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.033g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
208.086g/mol
Monoisotopic Mass:
207.033g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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