Products for Research Use Only

N'-Hydroxy-4-phenylbutanimidamide

CAT: 0926-AHA53214-01Size: 250 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0926-AHA53214-01Size:250 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
175532-14-6
MDL Number
MFCD09808080
Smiles
C1=CC=C (C=C1) CCCC (=NO) N
Molecular Formula
C10H14N2O
Molecular Weight
178.23 g/mol
Controlled
No

Chemical Information

N'-hydroxy-4-phenylbutanimidamide
CAS Number175532-14-6
PubChem CID15453905
IUPAC NameN'-hydroxy-4-phenylbutanimidamide
Molecular FormulaC10H14N2O
Molecular Weight178.23
XLogP1.7
Topological Polar Surface Area58.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Heavy Atom Count13
Formal Charge0
Complexity162
SMILES
C1=CC=C(C=C1)CCC/C(=N/O)/N
InChI
InChI=1S/C10H14N2O/c11-10(12-13)8-4-7-9-5-2-1-3-6-9/h1-3,5-6,13H,4,7-8H2,(H2,11,12)
InChIKey
FWWXQZGRILOAFP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N'-hydroxy-4-phenylbutanimidamide
CAS: 175532-14-6
CID: 15453905
Formula: C10H14N2O
MW: 178.23
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight178.23
XLogP31.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass178.110613074
Monoisotopic Mass178.110613074
Topological Polar Surface Area58.6 Ų
Heavy Atom Count13
Formal Charge0
Complexity162
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes