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Iminodibenzyl 98%

CAT: 0286-I00400-01Size: 25 gDry Ice: NoHazardous: No
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CAT#:0286-I00400-01Size:25 g
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CAS Number
494-19-9
Pictogram
07 - Irritant
UDF Signal Word
Warning
MDL Number
MFCD00005070
Hazard Statement
H302 Harmful if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H320 Causes 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

Iminodibenyl

core structure of clomipramine

CAS Number494-19-9
PubChem CID10308
IUPAC Name6,11-dihydro-5H-benzo[b][1]benzazepine
Molecular FormulaC14H13N
Molecular Weight195.26
XLogP3.8
Topological Polar Surface Area12
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count15
Formal Charge0
Complexity191
SMILES
C1CC2=CC=CC=C2NC3=CC=CC=C31
InChI
InChI=1S/C14H13N/c1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)15-13/h1-8,15H,9-10H2
InChIKey
ZSMRRZONCYIFNB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Iminodibenyl
CAS: 494-19-9
CID: 10308
Formula: C14H13N
MW: 195.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight195.26
XLogP33.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass195.104799419
Monoisotopic Mass195.104799419
Topological Polar Surface Area12 Ų
Heavy Atom Count15
Formal Charge0
Complexity191
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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