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4-Hydroxybenzamidine, Hydrochloride

CAT: 0572-TRC-H807525-10MGSize: 10 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-H807525-10MGSize:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
38148-63-9
Hazard Statement
Causes skin irritation
Smiles
Cl.NC(=N)c1ccc(O)cc1
Molecular Formula
C7 H8 N2 O . Cl H
Molecular Weight
172.61
InChI
InChI=1S/C7H8N2O.ClH/c8-7(9)5-1-3-6(10)4-2-5;/h1-4,10H,(H3,8,9);1H
Additionnal Information
IUPAC name: 4-hydroxybenzenecarboximidamide;hydrochloride
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

Benzenecarboximidamide, 4-hydroxy-, hydrochloride (1:1)
CAS Number38148-63-9
PubChem CID217124
IUPAC Name4-hydroxybenzenecarboximidamide;hydrochloride
Molecular FormulaC7H9ClN2O
Molecular Weight172.61
Topological Polar Surface Area70.1
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count11
Formal Charge0
Complexity128
SMILES
C1=CC(=CC=C1C(=N)N)O.Cl
InChI
InChI=1S/C7H8N2O.ClH/c8-7(9)5-1-3-6(10)4-2-5;/h1-4,10H,(H3,8,9);1H
InChIKey
VHVJRSVTZPYXEH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Benzenecarboximidamide, 4-hydroxy-, hydrochloride (1:1)
CAS: 38148-63-9
CID: 217124
Formula: C7H9ClN2O
MW: 172.61
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight172.61
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass172.0403406
Monoisotopic Mass172.0403406
Topological Polar Surface Area70.1 Ų
Heavy Atom Count11
Formal Charge0
Complexity128
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

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