Products for Research Use Only
RegisterLogin

2,6-Diaminotoluene

CAT: 0572-TRC-D416785-1GSize: 1 gDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0572-TRC-D416785-1GSize:1 g
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
823-40-5
Hazard Statement
Harmful if swallowed; UN number: UN3077; Packing Group: III
Purity
>95% (HPLC)
Smiles
Cc1c(N)cccc1N
Molecular Formula
C7 H10 N2
Molecular Weight
122.17
InChI
InChI=1S/C7H10N2/c1-5-6(8)3-2-4-7(5)9/h2-4H,8-9H2,1H3
Additionnal Information
IUPAC name: 2-methylbenzene-1,3-diamine
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

2,6-Diaminotoluene

2,6-diaminotoluene is a diamine that is toluene in which both of the hydrogens ortho- to the methyl group are replaced by amino groups. It has a role as a mutagen. It is a diamine and a primary amino compound. It derives from a hydride of a toluene.

CAS Number823-40-5
PubChem CID13205
IUPAC Name2-methylbenzene-1,3-diamine
Molecular FormulaC7H10N2
Molecular Weight122.17
XLogP0.9
Topological Polar Surface Area52
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count9
Formal Charge0
Complexity82
SMILES
CC1=C(C=CC=C1N)N
InChI
InChI=1S/C7H10N2/c1-5-6(8)3-2-4-7(5)9/h2-4H,8-9H2,1H3
InChIKey
RLYCRLGLCUXUPO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,6-Diaminotoluene
CAS: 823-40-5
CID: 13205
Formula: C7H10N2
MW: 122.17
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight122.17
XLogP30.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass122.084398327
Monoisotopic Mass122.084398327
Topological Polar Surface Area52 Ų
Heavy Atom Count9
Formal Charge0
Complexity82.9
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

Related Products

CatalogName
D4168252,3-Diaminotoluene
TRC-D416780-1G2,4-Diaminotoluene
TRC-D416780-10G2,4-Diaminotoluene
TRC-D416705-50G2,5-Diaminotoluene Sulfate
TRC-D416783-10MG2,4-Diaminotoluene-13C6
TRC-T535878-50MG2,5-Diaminotoluene-13C6
TRC-D416783-1MG2,4-Diaminotoluene-13C6
TRC-D416705-250G2,5-Diaminotoluene Sulfate
TRC-D416782-5MG2,4-Diaminotoluene-d3
TRC-D416705-25G2,5-Diaminotoluene Sulfate

Alternative Products

CatalogName
FD21502-012,6-Diaminotoluene
420705-012,6-Diaminotoluene-13C6
MBS6030289-012,6-Diaminotoluene-d3
D062102,6-Diaminotoluene 97%
438328-016-Chloro-2,3-diaminotoluene
CS-T-169442,4-Diaminotoluene
FD21500-012,3-Diaminotoluene
sc-3355332,5-Diaminotoluene
OR3157272,5-Diaminotoluene sulphate
D06200-012,4-Diaminotoluene 97%

Popular Products