4-Methoxyresorcinol

HCID 3083936CAS 6100-60-3
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1ccc(O)cc1O
InChIKey
GPJJASIJVRXZFI-UHFFFAOYSA-N
Molecular formula
C7H8O3
Average molar mass
140.14 g/mol
Monoisotopic mass
140.04734412

Overview

4-methoxybenzene-1,3-diol is a member of phenols and a member of methoxybenzenes.

Names & identifiers

Preferred name
4-Methoxyresorcinol
IUPAC
4-methoxybenzene-1,3-diol
English name
4-Methoxyresorcinol
Molecular formula
C7H8O3
Molecular weight
140.14

Names & synonyms

4-METHOXYRESORCINOLRefChem:4137714-methoxybenzene-1,3-diol6100-60-34-Methoxy-1,3-benzenediol1,3-Benzenediol, 4-methoxy-2,4-dihydroxyanisoleMFCD00210443methoxyresorcinol4-methoxyresorcine4-methoxy-benzene-1,3-diolSCHEMBL68212
Show more names
Pyridoxine Impurity 413-Hydroxy-4-Methoxyphenol1,10-Phenanthroline-5,6-dione,2,11-dimethyl-4-Methoxy-1,3-benzenediol, 4-Methoxyresorcinol
CHEBI:193962DTXSID202098714-Methoxy-1,3-benzenediol; 4-Methoxy-resorcinol; 2,4-Dihydroxyanisole; 3-Hydroxy-4-methoxyphenol; 4-MethoxyresorcinolBCP300644-Methoxy-resorcinolorb3029341SCHEMBL28093164SCHEMBL28169114

Database identifiers

CAS
6100-60-3
PubChem CID
3083936
DTXSID
DTXSID20209871
ChEBI
CHEBI:193962
EC Number
813-306-1
Nikkaji
J741.411K

Properties

Computed structural properties

XLogP
0.5
Topological polar surface area
49.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
10

Physicochemical properties

Melting point
66 °C · 66 °C
Boiling point
123 · 123-125 °C(Press: 1.5 Torr)
Density
1.27 · 1.270±0.06 g/cm3(Predicted)
storage temp.
Keep in dark place,Sealed in dry,Room Temperature
solubility
DMSO (Slightly), Methanol (Slightly)
form
Solid

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

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

P264, P270, P273, P301+P317, P330, P391, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

hs_code
2902900000
Signal word
Warning
Symbol(GHS)
GHS07
hazard_class
IRRITANT
Hazard statements
H302+H312+H332-H315-H319-H335
Precautionary statements
P260-P280-P312

Chemistry & industry

Applications

Uses4-Methoxyresorcinol (cas# 6100-60-3) is a compound useful in organic synthesis.

Upstream & downstream products

Suppliers50 total

上海康恩博医药科技有限公司17510465506 · [email protected]
上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
上海策嵘生物科技有限公司[email protected]
安徽合诺生物科技有限公司0555-2761852
T&W GROUP021-61551611 13296011611 · [email protected]

Additional notes

DefinitionChEBI: 4-methoxybenzene-1,3-diol is a member of phenols and a member of methoxybenzenes.

Related reactions

7 records
New reaction record

Linked notes

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