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77197-09-2 | Guanidine, (1-methylethyl)-, sulfate (2:1)
CAS No: 77197-09-2 Catalog No: AG00557I MDL No:MFCD00035595
Product Description
Catalog Number:
AG00557I
Chemical Name:
Guanidine, (1-methylethyl)-, sulfate (2:1)
CAS Number:
77197-09-2
Molecular Formula:
C8H24N6O4S
Molecular Weight:
300.3790
MDL Number:
MFCD00035595
IUPAC Name:
2-propan-2-ylguanidine;sulfuric acid
InChI:
InChI=1S/2C4H11N3.H2O4S/c2*1-3(2)7-4(5)6;1-5(2,3)4/h2*3H,1-2H3,(H4,5,6,7);(H2,1,2,3,4)
InChI Key:
MFIQZHWDRVKGAK-UHFFFAOYSA-N
SMILES:
OS(=O)(=O)O.CC(NC(=N)N)C.CC(NC(=N)N)C
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.158g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
6
Isotope Atom Count:
0
Molecular Weight:
300.378g/mol
Monoisotopic Mass:
300.158g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
212A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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