(5-Methylthiophen-2-yl)methanol

HCID 528074

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Basic information

CAS: 63826-59-5
Standard SMILES: Cc1ccc(CO)s1
InChIKey: YAWGNFISLHMUDV-UHFFFAOYSA-N
Molecular formula: C6H8OS
Average molar mass: 128.19 g/mol
Monoisotopic mass: 128.02958588

Names & identifiers

Preferred name: (5-Methylthiophen-2-yl)methanol
IUPAC: (5-methylthiophen-2-yl)methanol
English name: RARECHEM AL BD 0181
Molecular formula: C6H8OS
Molecular weight: 128.19

Names & synonyms

(5-methylthiophen-2-yl)methanolRefChem:404145811-973-363826-59-5(5-methyl-2-thienyl)methanolMFCD062026275-Methyl-2-thiophenemethanol2-thiophenemethanol, 5-methyl-SCHEMBL93014SCHEMBL1277865-methyl-2-thiophene methanolSCHEMBL27829407

Show more names

RARECHEM AL BDRARECHEM AL BD 01815-METHYL THIOPHENE-2-METHANOL(5-Methylthiophen-2-yl)methanol - [M90197]

5-methyl-2-hydroxymethylthiopheneDTXSID703359372-Hydroxymethyl-5-methyl-thiophene(5-methyl-thiophen-2-yl)-methanolNCA82659AKOS000321035BS-3765SY083528

Database identifiers

CAS: 63826-59-5
PubChem CID: 528074
DTXSID: DTXSID70335937
EC Number: 811-973-3
Nikkaji: J1.480.180D

Properties

Computed structural properties

XLogP: 1.2
Topological polar surface area: 48.5 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 8
Formal charge: 0
Complexity: 74.9

Physicochemical properties

storage temp.: -20 °C · Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
Appearance: Colorless to light yellow Liquid
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 233 · P233-P260-P261-P264-P270-P271-P280-P301+P312-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P330-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
HS Code: 2934999090 · 2934999090

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

hs_code: 2934999090
Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H302-H315-H319-H335
Precautionary statements: P233-P260-P261-P264-P270-P271-P280-P301+P312-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P330-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501