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28456-39-5 | Benzenecarboximidamide, 4-butyl-
CAS No: 28456-39-5 Catalog No: AG002VCQ MDL No:MFCD05662844
Product Description
Catalog Number:
AG002VCQ
Chemical Name:
Benzenecarboximidamide, 4-butyl-
CAS Number:
28456-39-5
Molecular Formula:
C11H16N2
Molecular Weight:
176.2581
MDL Number:
MFCD05662844
IUPAC Name:
4-butylbenzenecarboximidamide
InChI:
InChI=1S/C11H16N2/c1-2-3-4-9-5-7-10(8-6-9)11(12)13/h5-8H,2-4H2,1H3,(H3,12,13)
InChI Key:
QBXVSDIRVLEZRX-UHFFFAOYSA-N
SMILES:
CCCCc1ccc(cc1)C(=N)N
Properties
Complexity:
158
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:
4
Topological Polar Surface Area:
49.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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