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1257106-74-3 | 4-Pyrimidinemethanamine, α-methyl-, hydrochloride (1:2)
CAS No: 1257106-74-3 Catalog No: AG000OJC MDL No:MFCD09864614
Product Description
Catalog Number:
AG000OJC
Chemical Name:
4-Pyrimidinemethanamine, α-methyl-, hydrochloride (1:2)
CAS Number:
1257106-74-3
Molecular Formula:
C6H11Cl2N3
Molecular Weight:
196.0776
MDL Number:
MFCD09864614
IUPAC Name:
1-pyrimidin-4-ylethanamine;dihydrochloride
InChI:
InChI=1S/C6H9N3.2ClH/c1-5(7)6-2-3-8-4-9-6;;/h2-5H,7H2,1H3;2*1H
InChI Key:
XPVFVFAOQUGQDG-UHFFFAOYSA-N
SMILES:
CC(c1ccncn1)N.Cl.Cl
Properties
Complexity:
84.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.033g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
196.075g/mol
Monoisotopic Mass:
195.033g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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