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102142-91-6 | Carbamimidic acid, 1,1-dimethylethyl ester
CAS No: 102142-91-6 Catalog No: AG0006QP MDL No:
Product Description
Catalog Number:
AG0006QP
Chemical Name:
Carbamimidic acid, 1,1-dimethylethyl ester
CAS Number:
102142-91-6
Molecular Formula:
C5H12N2O
Molecular Weight:
116.1616
IUPAC Name:
tert-butyl carbamimidate
InChI:
InChI=1S/C5H12N2O/c1-5(2,3)8-4(6)7/h1-3H3,(H3,6,7)
InChI Key:
SEBFEOANNMLCCB-UHFFFAOYSA-N
SMILES:
NC(=N)OC(C)(C)C
Properties
Complexity:
93.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
116.095g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
116.164g/mol
Monoisotopic Mass:
116.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
59.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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