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31066-04-3 | Benzenecarboximidamide, 3-(heptyloxy)-
CAS No: 31066-04-3 Catalog No: AG003215 MDL No:
Product Description
Catalog Number:
AG003215
Chemical Name:
Benzenecarboximidamide, 3-(heptyloxy)-
CAS Number:
31066-04-3
Molecular Formula:
C14H22N2O
Molecular Weight:
234.3373
IUPAC Name:
3-heptoxybenzenecarboximidamide
InChI:
InChI=1S/C14H22N2O/c1-2-3-4-5-6-10-17-13-9-7-8-12(11-13)14(15)16/h7-9,11H,2-6,10H2,1H3,(H3,15,16)
InChI Key:
PWRMFIPHUUKDAA-UHFFFAOYSA-N
SMILES:
CCCCCCCOc1cccc(c1)C(=N)N
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.173g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
234.343g/mol
Monoisotopic Mass:
234.173g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
59.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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