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3-(1-[(4-METHYLPHENYL)SULFONYL]-1H-INDOL-3-YL)ACRYLICACID

3-(1-[(4-METHYLPHENYL)SULFONYL]-1H-INDOL-3-YL)ACRYLICACID structure

CAS No:
298187-97-0
Formula:
C18H15NO4S
Chemical Name:
3-(1-[(4-METHYLPHENYL)SULFONYL]-1H-INDOL-3-YL)ACRYLICACID
Synonyms:
RARECHEM AL BK 0453;3-(1-[(4-METHYLPHENYL)SULFONYL]-1H-INDOL-3-YL)ACRYLIC ACID;3-{1-[(4-methylphenyl)sulphonyl]-1H-indol-3-yl}acrylic acid;3-{1-[(4-Methylphenyl)sulphonyl]-1H-indol-3-yl}prop-2-enoic acid, 3-(2-Carboxyethenyl)-1-[(4-methylphenyl)sulphonyl]-1H-indole;(E)-3-(1-tosyl-1H-indol-3-yl)acrylicacid;(2E)-3-[1-(4-methylbenzenesulfonyl)-1H-indol-3-yl]prop-2-enoic acid;2-Propenoic acid, 3-[1-[(4-methylphenyl)sulfonyl]-1H-indol-3-yl]-

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3-(1-[(4-METHYLPHENYL)SULFONYL]-1H-INDOL-3-YL)ACRYLICACID Basic Attributes

Molecular Weight：

341.38

Exact Mass：

341.07217913

Characteristics

Density：

1.30±0.1 g/cm3

Melting Point：

238 °C

Boiling Point：

588.1±52.0 °C(Predicted)

PKA：

4.19±0.10

Computed Properties

Molecular Weight:341.4
XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:341.07217913
Monoisotopic Mass:341.07217913
Topological Polar Surface Area:84.8
Heavy Atom Count:24
Complexity:587
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-(1-[(4-METHYLPHENYL)SULFONYL]-1H-INDOL-3-YL)ACRYLICACID

Basic Attributes
Characteristics
Computed Properties

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