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889940-63-0 | 2-tert-butyl-5-hydrazinyl-1,3-oxazole-4-carbonitrile
CAS No: 889940-63-0 Catalog No: AG01A7RY MDL No:MFCD08436229
Product Description
Catalog Number:
AG01A7RY
Chemical Name:
2-tert-butyl-5-hydrazinyl-1,3-oxazole-4-carbonitrile
CAS Number:
889940-63-0
Molecular Formula:
C8H12N4O
Molecular Weight:
180.2071
MDL Number:
MFCD08436229
IUPAC Name:
2-tert-butyl-5-hydrazinyl-1,3-oxazole-4-carbonitrile
InChI:
InChI=1S/C8H12N4O/c1-8(2,3)7-11-5(4-9)6(12-10)13-7/h12H,10H2,1-3H3
InChI Key:
LCJOUPGKBCXCJA-UHFFFAOYSA-N
SMILES:
NNc1oc(nc1C#N)C(C)(C)C
Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.101g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
180.211g/mol
Monoisotopic Mass:
180.101g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
87.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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