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4-Chlorobenzamidine Hydriodide

CAT: 0286-C09235Size: 5 gDry Ice: NoHazardous: No
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CAT#:0286-C09235Size:5 g
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CAS Number
115297-57-9
Pictogram
07 - Irritant
UDF Signal Word
Warning
MDL Number
MFCD00051987
Hazard Statement
H302 Harmful if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H319 Causes serious eye irritation; H332 Harmful if inhaled; H335 May cause respiratory irritation.
DOT Name
Not D.O.T.-Regulated
Precautions
P261 Avoid breathing dust/fume/gas/mist/vapors/spray; P280 Wear protective gloves/protective clothing/eye protection/face protection; P301+P312 IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell; P302+P352 IF ON SKIN: wash with plenty of soap and water; P304+P340 IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing; P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P332+P313 IF SKIN irritation occurs: Get medical advice/attention.

Chemical Information

4-Chlorobenzamidine hydroiodide
CAS Number115297-57-9
PubChem CID2734221
IUPAC Name4-chlorobenzenecarboximidamide;hydroiodide
Molecular FormulaC7H8ClIN2
Molecular Weight282.51
Topological Polar Surface Area49.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count11
Formal Charge0
Complexity128
SMILES
C1=CC(=CC=C1C(=N)N)Cl.I
InChI
InChI=1S/C7H7ClN2.HI/c8-6-3-1-5(2-4-6)7(9)10;/h1-4H,(H3,9,10);1H
InChIKey
YMEVGWRZEYGNJO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-Chlorobenzamidine hydroiodide
CAS: 115297-57-9
CID: 2734221
Formula: C7H8ClIN2
MW: 282.51
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight282.51
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass281.94207
Monoisotopic Mass281.94207
Topological Polar Surface Area49.9 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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