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1,2,5-Trimethylpyrrole - >98.0%(GC), high purity , CAS No.930-87-0

COA

Grade & Purity:

≥98%(GC)

Cas Number: 930-87-0
Molecular Weight: 109.17
Beilstein Registry Number: 20(5)5,65
MDL number: MFCD00003090
PubChem CID: 70260
PubChem SID: 488184505

In stock

Item Number

T161834

Grouped product items
SKU	Size	Availability	Price	Qty
T161834-1ml	1ml	10	$10.90
T161834-5ml	5ml	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$39.90

View related series

azole (525) Halogen free heterocyclic block (1207)

Basic Description

Synonyms	T1939 \| NSC81220 \| NSC-81220 \| EINECS 213-225-6 \| EN300-21742 \| Q63396362 \| DTXSID20239239 \| SY048165 \| D92550 \| 1,2,5-Trimethylpyrrole, 99% \| AS-78356 \| 7K4P5HS0RP \| FT-0606265 \| AKOS000101244 \| 1,2,5-Trimethylpyrrole \| 1,2,5-Trimethyl-1H-pyrrole \| 1H-Py
Specifications & Purity	≥98%(GC)
Storage Temp	Protected from light,Argon charged
Shipped In	Normal
Product Description	1,2,5-Trimethylpyrrole is used as an organic chemical synthesis intermediate.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Pyrroles
    - Subclass Substituted pyrroles
      - Level5 N-substituted pyrroles
        Level6 N-methylpyrroles

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Pyrroles
Subclass	Substituted pyrroles
Intermediate Tree Nodes	N-substituted pyrroles
Direct Parent	N-methylpyrroles
Alternative Parents	Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	N-methylpyrrole - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as n-methylpyrroles. These are organic heterocyclic compounds containing a N-methylated pyrrole.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

Pubchem Sid	488184505
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488184505
IUPAC Name	1,2,5-trimethylpyrrole
INCHI	InChI=1S/C7H11N/c1-6-4-5-7(2)8(6)3/h4-5H,1-3H3
InChIKey	YRABRACUKBOTKB-UHFFFAOYSA-N
Smiles	CC1=CC=C(N1C)C
Isomeric SMILES	CC1=CC=C(N1C)C
WGK Germany	3
PubChem CID	70260
UN Number	1993
Packing Group	III
Molecular Weight	109.17
Beilstein	20(5)5,65
Reaxy-Rn	107604

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

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6 results found

Lot Number	Certificate Type	Date	Item
J2225488	Certificate of Analysis	Aug 24, 2022	T161834
J2225487	Certificate of Analysis	Aug 24, 2022	T161834
E2306835	Certificate of Analysis	Aug 24, 2022	T161834
C2218334	Certificate of Analysis	Feb 17, 2022	T161834
C2218367	Certificate of Analysis	Feb 17, 2022	T161834
B2225147	Certificate of Analysis	Jan 26, 2022	T161834

Chemical and Physical Properties

Solubility	Slightly soluble in water (2.2 g/L at 25°C).
Sensitivity	Air&Light sensitive
Refractive Index	n20/D 1.498 (lit.)
Flash Point(°F)	125.6 °F
Flash Point(°C)	52°C(lit.)
Boil Point(°C)	173 °C (lit.)
Molecular Weight	109.170 g/mol
XLogP3	1.500
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	0
Exact Mass	109.089 Da
Monoisotopic Mass	109.089 Da
Topological Polar Surface Area	4.900 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	70.500
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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