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1-Methyl-4-(methylsulfonyl)-2-nitrobenzene

1-Methyl-4-(methylsulfonyl)-2-nitrobenzene structure

CAS No:
1671-49-4
Formula:
C8H9NO4S
Chemical Name:
1-Methyl-4-(methylsulfonyl)-2-nitrobenzene
Synonyms:
Benzene,1-methyl-4-(methylsulfonyl)-2-nitro-;Sulfone,methyl 3-nitro-p-tolyl;1-Methyl-4-(methylsulfonyl)-2-nitrobenzene;4-Methylsulfonyl-2-nitrotoluene;1-Methyl-4-methylsulfonyl-2-nitrobenzene;4-Methylsulfonyl-1-methyl-2-nitrobenzene;2-Nitro-4-methylsulfonyltoluene;2-Nitro-4-methanesulfone toluene
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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1-Methyl-4-(methylsulfonyl)-2-nitrobenzene Basic Attributes

Molecular Weight：

215.22600

Exact Mass：

215.23

EC Number：

430-550-0|605-469-0

DSSTox ID：

DTXSID30350742

HScode：

2904909090

Characteristics

PSA：

88.34000

XLogP3：

2.91070

Density：

1.35g/cm3

Melting Point：

118-121 °C @ Solvent: Methanol

Boiling Point：

387.8ºC at 760mmHg

Flash Point：

188.3ºC

Refractive Index：

1.551

Vapor Pressure：

7.16E-06mmHg at 25°C

Safety Information

Transport codes：

UN 2811

hazard class code：

R23/24/25

safety instructions：

S26; S36/37/39

GHS Classification：

|Warning|H302: Harmful if swallowed [Warning Acute toxicity, oral]|P201, P202, P261, P264, P270, P272, P273, P280, P281, P301+P312, P302+P352, P308+P313, P321, P330, P333+P313, P363, P405, and P501|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|Aggregated GHS information provided by 33 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|Aggregated GHS information provided by 199 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:215.23
XLogP3:1.7
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:215.02522894
Monoisotopic Mass:215.02522894
Topological Polar Surface Area:88.3
Heavy Atom Count:14
Complexity:313
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Recommended Suppliers of 1-Methyl-4-(methylsulfonyl)-2-nitrobenzene

Hangzhou KieRay Chem Co.,LTD Contact Supplier

CN
5 YRS

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Manufactory Supplier of fine chemicals,pharmaceutical materials

2-Nitro-4-methylsulfonyltoluene

CAS No.: 1671-49-4

Grade: industrial Grade

Content: 98%

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Hangzhou Royalchem Co.,LTD Contact Supplier

CN
2 YRS

Business licensed

Trader Supplier of Pharmaceutical intermediates

2-Nitro-4-methylsulfonyltoluene RC08997

Unit Price: $1 /KG EXW

CAS No.: 1671-49-4

Grade: Industrial Grade

Content: 99%

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Guide of 1-Methyl-4-(methylsulfonyl)-2-nitrobenzene

Basic Attributes
Characteristics
Safety Information
Computed Properties
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