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Benzidine-d8

CAT: 0572-TRC-B121002-10MGSize: 10 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-B121002-10MGSize:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
92890-63-6
Synonyms
4,4'-Diamino(biphenyl-d8)
Hazard Statement
Harmful if swallowed; UN number: UN1885; Packing Group: II
Purity
>95% (HPLC)
Smiles
[2H]c1c([2H])c(c([2H])c([2H])c1N)c2c([2H])c([2H])c(N)c([2H])c2[2H]
Molecular Formula
C12 2H8 H4 N2
Molecular Weight
192.29
InChI
InChI=1S/C12H12N2/c13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10/h1-8H,13-14H2/i1D,2D,3D,4D,5D,6D,7D,8D
Additionnal Information
IUPAC name: 4-(4-amino-2,3,5,6-tetradeuteriophenyl)-2,3,5,6-tetradeuterioaniline
Shipping Conditions
Room Temperature
Storage Conditions
+20°C

Chemical Information

(~2~H_8_)(1,1'-Biphenyl)-4,4'-diamine
CAS Number92890-63-6
PubChem CID16213883
IUPAC Name4-(4-amino-2,3,5,6-tetradeuteriophenyl)-2,3,5,6-tetradeuterioaniline
Molecular FormulaC12H12N2
Molecular Weight192.29
XLogP1.3
Topological Polar Surface Area52
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count14
Formal Charge0
Complexity145
SMILES
[2H]C1=C(C(=C(C(=C1C2=C(C(=C(C(=C2[2H])[2H])N)[2H])[2H])[2H])[2H])N)[2H]
InChI
InChI=1S/C12H12N2/c13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10/h1-8H,13-14H2/i1D,2D,3D,4D,5D,6D,7D,8D
InChIKey
HFACYLZERDEVSX-PGRXLJNUSA-N
Chemical Structure
2D Structure
2D structure of (~2~H_8_)(1,1'-Biphenyl)-4,4'-diamine
CAS: 92890-63-6
CID: 16213883
Formula: C12H12N2
MW: 192.29
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight192.29
XLogP31.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass192.150262359
Monoisotopic Mass192.150262359
Topological Polar Surface Area52 Ų
Heavy Atom Count14
Formal Charge0
Complexity145
Isotope Atom Count8
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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