Benzene, 2,4-dimethoxy-1-methyl-

HCID 96403CAS 38064-90-3
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1ccc(C)c(OC)c1
InChIKey
OSNMRWURXNWCGA-UHFFFAOYSA-N
Molecular formula
C9H12O2
Average molar mass
152.19 g/mol
Monoisotopic mass
152.08372962

Names & identifiers

Preferred name
Benzene, 2,4-dimethoxy-1-methyl-
IUPAC
2,4-dimethoxy-1-methylbenzene
English name
2,4-DIMETHOXYTOLUENE
Molecular formula
C9H12O2
Molecular weight
152.19

Names & synonyms

2,4-Dimethoxy-1-methylbenzeneBenzene, 2,4-dimethoxy-1-methyl-DTXSID70191474NSC 72351RefChem:562549DTXCID80113965609-515-0InChI=1/C9H12O2/c1-7-4-5-8(10-2)6-9(7)11-3/h4-6H,1-3H2,4-Dimethoxytoluene38064-90-3MFCD00010749NSC72351
Show more names
2,4-dimethoxymethylbenzeneBenzene, 1,3-dimethoxy-4-methyl
2,4-DIMETHOXY-1-METHYL-BENZENE2,4-Dimethoxytoluene, 99%SCHEMBL113300SCHEMBL113301SCHEMBL126703SCHEMBL140807SCHEMBL748238orb2939405

Database identifiers

CAS
38064-90-3
PubChem CID
96403
DTXSID
DTXSID70191474
EC Number
609-515-0
Nikkaji
J633.419I

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
18.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
11

Experimental & physicochemical properties

Kovats Retention Index1244

Physicochemical properties

Boiling point
110 · 110-120 °C30 mm Hg(lit.)
Density
1.036 g/mL · 1.036 g/mL at 25 °C(lit.)
refractive index
20 · n20/D 1.524(lit.)
Flash point
199 °F · 199 °F
storage temp.
room temp
form
liquid

Safety & regulation

GHS classification

GHS Classification · 5 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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

Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (100%)

Safety data

PPE
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
wgk
3
ridadr
NA 1993 / PGIII
risk_code
36/37/38
Signal word
Warning
Symbol(GHS)
GHS07

Chemistry & industry

Applications

Usesdiagnostic assay manufacturinghematologyhistology

Upstream & downstream products

Suppliers38 total

国药集团化学试剂有限公司86-21-63210123 · [email protected]
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

Related reactions

6 records
New reaction record

Linked notes

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