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1-(o-Tolyl)biguanide - >97.0%(T), high purity , CAS No.93-69-6

COA

Grade & Purity:

≥97%(T)

Cas Number: 93-69-6
Molecular Weight: 191.24
MDL number: MFCD00019731
PubChem CID: 7155
PubChem SID: 488180317

In stock

Item Number

O159965

Grouped product items
SKU	Size	Availability	Price
O159965-25g	25g	4	$25.90
O159965-100g	100g	4	$69.90
O159965-500g	500g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$245.90

View related series

Nitrogenous compounds (2445) Non heterocyclic block (8163)

Basic Description

Synonyms	1-carbamimidamido-N-(2-methylphenyl)methanimidamide \| FT-0605844 \| UNII-5T9Z06LCV4 \| o-Tolyl biguanide \| W-100231 \| Imidodicarbonimidic diamide, N-(methylphenyl)- (9CI) \| F3297-0020 \| NSC 164906 \| BRN 0612193 \| EC 202-268-6 \| STK102789 \| EINECS 202-268-6
Specifications & Purity	≥97%(T)
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Toluenes

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Toluenes
Intermediate Tree Nodes	Not available
Direct Parent	Toluenes
Alternative Parents	Biguanides Propargyl-type 1,3-dipolar organic compounds Carboximidamides Organopnictogen compounds Imines Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Toluene - Biguanide - Guanidine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Imine - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as toluenes. These are compounds containing a benzene ring which bears a methane group.
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	488180317
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488180317
IUPAC Name	1-(diaminomethylidene)-2-(2-methylphenyl)guanidine
INCHI	InChI=1S/C9H13N5/c1-6-4-2-3-5-7(6)13-9(12)14-8(10)11/h2-5H,1H3,(H6,10,11,12,13,14)
InChIKey	SQZCAOHYQSOZCE-UHFFFAOYSA-N
Smiles	CC1=CC=CC=C1N=C(N)N=C(N)N
Isomeric SMILES	CC1=CC=CC=C1N=C(N)N=C(N)N
WGK Germany	1
RTECS	DU2800000
PubChem CID	7155
Molecular Weight	191.24
Reaxy-Rn	612193

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

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

Analytical Chart:

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2 results found

Lot Number	Certificate Type	Date	Item
F1905015	Certificate of Analysis	Mar 07, 2023	O159965
K2415078	Certificate of Analysis	Nov 23, 2021	O159965

Chemical and Physical Properties

Solubility	Slightly soluble in water; easily soluble in acetone and ethanol; soluble in methanol; slightly soluble in benzene and chloroform; very slightly soluble in toluene
Flash Point(°F)	235.4 °F
Flash Point(°C)	113 °C
Melt Point(°C)	147 °C
Molecular Weight	191.230 g/mol
XLogP3	0.300
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	191.117 Da
Monoisotopic Mass	191.117 Da
Topological Polar Surface Area	103.000 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	242.000
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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