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P-Phenetidine Hydrochloride

CAT: 0024-sc-489044Size: 25 gDry Ice: NoHazardous: No
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CAT#:0024-sc-489044Size:25 g
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CAS Number
637-56-9

Chemical Information

Benzenamine, 4-ethoxy-, hydrochloride (1:1)
CAS Number637-56-9
PubChem CID69478
IUPAC Name4-ethoxyaniline;hydrochloride
Molecular FormulaC8H12ClNO
Molecular Weight173.64
Topological Polar Surface Area35.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count11
Formal Charge0
Complexity87
SMILES
CCOC1=CC=C(C=C1)N.Cl
InChI
InChI=1S/C8H11NO.ClH/c1-2-10-8-5-3-7(9)4-6-8;/h3-6H,2,9H2,1H3;1H
InChIKey
JVWYCUBGJVOEIZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Benzenamine, 4-ethoxy-, hydrochloride (1:1)
CAS: 637-56-9
CID: 69478
Formula: C8H12ClNO
MW: 173.64
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight173.64
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass173.0607417
Monoisotopic Mass173.0607417
Topological Polar Surface Area35.3 Ų
Heavy Atom Count11
Formal Charge0
Complexity87.3
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes