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2,3,5-Trimethylpyridine

CAT: 0572-TRC-T796700-5GSize: 5 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-T796700-5GSize:5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
695-98-7
Synonyms
2,3,5-Collidine; 2,3,5-Trimethyl-pyridine;
Hazard Statement
Combustible liquid and vapour.
Smiles
Cc1cnc(C)c(C)c1
Molecular Formula
C8H11N
Molecular Weight
121.18
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

2,3,5-Trimethylpyridine
CAS Number695-98-7
PubChem CID12759
IUPAC Name2,3,5-trimethylpyridine
Molecular FormulaC8H11N
Molecular Weight121.18
XLogP2
Topological Polar Surface Area12.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count9
Formal Charge0
Complexity90
SMILES
CC1=CC(=C(N=C1)C)C
InChI
InChI=1S/C8H11N/c1-6-4-7(2)8(3)9-5-6/h4-5H,1-3H3
InChIKey
GFYHSKONPJXCDE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,3,5-Trimethylpyridine
CAS: 695-98-7
CID: 12759
Formula: C8H11N
MW: 121.18
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight121.18
XLogP32
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass121.089149355
Monoisotopic Mass121.089149355
Topological Polar Surface Area12.9 Ų
Heavy Atom Count9
Formal Charge0
Complexity90.6
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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Alternative Products

CatalogName
FT02862-012,3,5-Trimethylpyridine
15131983-25g2,3,5-Collidine (2,3,5-Trimethylpyridine)
MBS6024770-012,3,5-Trimethylpyridine N-Oxide
OR81082-014-Methoxy-2,3,5-trimethylpyridine
OR1009965-012,3,5-Trimethylpyridine 1-Oxide
419929-012,3,4-Trimethylpyridine
OR1083795-012,3,6-Trimethylpyridine
OR1025268-012,4,6-Trimethylpyridine-3,5-Dicarbonitrile
OR255562,4-dichloro-3,5,6-trimethylpyridine
GJB21404-012,5,6-Trimethylpyridine-3-carboxylic acid

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