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Home > Encyclopedia > 4-Amino-N-methylbenzenemethanesulfonamide

4-Amino-N-methylbenzenemethanesulfonamide

4-Amino-N-methylbenzenemethanesulfonamide structure

4-Amino-N-methylbenzenemethanesulfonamide 

structure
  • CAS No:

    109903-35-7

  • Formula:

    C8H12N2O2S

  • Chemical Name:

    4-Amino-N-methylbenzenemethanesulfonamide

  • Synonyms:

    Benzenemethanesulfonamide,4-amino-N-methyl-;4-Amino-N-methylbenzenemethanesulfonamide;4-(((Methylamino)sulfonyl)methyl)aniline;1-(4-Aminophenyl)-N-methylmethanesulfonamide

  • Categories:

    Organic Chemistry  >  Amides

4-Amino-N-methylbenzenemethanesulfonamide Basic Attributes

200.26

200.26

5865321

-0

DTXSID90380787

2935009090

Characteristics

80.6

0.1

1.297±0.06 g/cm3(Predicted)

140-142 °C(lit.)

387.6±44.0 °C(Predicted)

188.2±28.4 °C

1.590

3.25E-06mmHg at 25°C

Safety Information

III

9

UN 2811 6.1/PG 3

3

22-43

36/37

Xn,Xi

Irritant

P280-P301 + P310

H301-H317

|Danger|H301 (86.36%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P272, P273, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P333+P313, P337+P313, P362, P363, P391, P403+P233, P405, and P501|Aggregated GHS information provided by 44 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

4-Amino-N-methylbenzenemethanesulfonamide Use and Manufacturing

4-Amino-N-methyl-α-toluenesulfonamide is an intermediate used in the synthesis of Sumatriptan (S810000).

Computed Properties

Molecular Weight:200.26
XLogP3:0.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:200.06194880
Monoisotopic Mass:200.06194880
Topological Polar Surface Area:80.6
Heavy Atom Count:13
Complexity:237
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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