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125772-42-1 | Benzenecarboximidamide, 4-(1,1-dimethylethyl)-
CAS No: 125772-42-1 Catalog No: AG000OOZ MDL No:MFCD05662846
Product Description
Catalog Number:
AG000OOZ
Chemical Name:
Benzenecarboximidamide, 4-(1,1-dimethylethyl)-
CAS Number:
125772-42-1
Molecular Formula:
C11H16N2
Molecular Weight:
176.2581
MDL Number:
MFCD05662846
IUPAC Name:
4-tert-butylbenzenecarboximidamide
InChI:
InChI=1S/C11H16N2/c1-11(2,3)9-6-4-8(5-7-9)10(12)13/h4-7H,1-3H3,(H3,12,13)
InChI Key:
NFNSHLXROFMSCN-UHFFFAOYSA-N
SMILES:
NC(=N)c1ccc(cc1)C(C)(C)C
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.131g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
176.263g/mol
Monoisotopic Mass:
176.131g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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