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2-(m-Tolyl)ethanol - 98%, high purity , CAS No.1875-89-4

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2-(m-Tolyl)ethanol - 98%, high purity , CAS No.1875-89-4

COA

Grade & Purity:

≥98%

Cas Number: 1875-89-4
Molecular Weight: 136.19
Beilstein Registry Number: 6508
MDL number: MFCD00002896
PubChem CID: 74648
PubChem SID: 488184959

In stock

Item Number

M157912

Grouped product items
SKU	Size	Availability	Price
M157912-1g	1g	3	$23.90
M157912-5g	5g	9	$89.90
M157912-25g	25g	1	$266.90
M157912-100g	100g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$961.90

View related series

alcohol (850) Non heterocyclic block (8163)

Basic Description

Synonyms	Benzactyzine methobromide \| CK1130 \| EINECS 217-508-5 \| UNII-Z8WAA9JXV7 \| EN300-96197 \| MFCD00002896 \| NSC 81215 \| Z8WAA9JXV7 \| m-Methylphenethyl alcohol \| DS-2320 \| TS-01759 \| Benzeneethanol, 3-methyl- \| M1376 \| 2-m-Tolylethanol \| 2-m-tolyl-ethanol \| InC
Specifications & Purity	≥98%
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	Primary alcohols Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Toluene - Organic oxygen compound - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Alcohol - 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

Associated Targets(non-human)

Pseudomonas aeruginosa (123386 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

Pubchem Sid	488184959
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488184959
IUPAC Name	2-(3-methylphenyl)ethanol
INCHI	InChI=1S/C9H12O/c1-8-3-2-4-9(7-8)5-6-10/h2-4,7,10H,5-6H2,1H3
InChIKey	KWHVBVJDKLSOTB-UHFFFAOYSA-N
Smiles	CC1=CC(=CC=C1)CCO
Isomeric SMILES	CC1=CC(=CC=C1)CCO
WGK Germany	3
Molecular Weight	136.19
Beilstein	6508
Reaxy-Rn	2040906
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2040906&ln=

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

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

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

3 results found

Lot Number	Certificate Type	Date	Item
L1910089	Certificate of Analysis	Sep 08, 2023	M157912
C23211059	Certificate of Analysis	Mar 25, 2023	M157912
L2219117	Certificate of Analysis	Dec 26, 2022	M157912

Chemical and Physical Properties

Refractive Index	1.53
Flash Point(°F)	228.2 °F
Flash Point(°C)	109°C(lit.)
Boil Point(°C)	243°C(lit.)
Molecular Weight	136.190 g/mol
XLogP3	1.900
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	136.089 Da
Monoisotopic Mass	136.089 Da
Topological Polar Surface Area	20.200 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	90.700
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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