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1-(PHENYLSULFONYL)-1H-INDOLE-3-CARBOXYLICACID

1-(PHENYLSULFONYL)-1H-INDOLE-3-CARBOXYLICACID structure

CAS No:
278593-17-2
Formula:
C15H11NO4S
Chemical Name:
1-(PHENYLSULFONYL)-1H-INDOLE-3-CARBOXYLICACID
Synonyms:
RARECHEM AL BE 1326;1-(PHENYLSULFONYL)-1H-INDOLE-3-CARBOXYLIC ACID;1-PHENYLSULPHONYLINDOLE-3-CARBOXYLIC ACID;1-(Phenylsulphonyl)indole-3-carboxylic acid 97%;1-(Phenylsulphonyl)indole-3-carboxylicacid97%;1-(phenylsulfonyl)-3-indolecarboxylic acid;1-(Phenylsulphonyl)-1H-indole-3-carboxylic acid 97%;3-Carboxy-1-(phenylsulphonyl)-1H-indole, 3-Carboxy-1H-indol-1-yl phenyl sulphone

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1-(PHENYLSULFONYL)-1H-INDOLE-3-CARBOXYLICACID Basic Attributes

Molecular Weight：

301.32

Exact Mass：

301.04087901 g/mol

DSSTox ID：

DTXSID10353034

Characteristics

PSA：

84.8 Å²

Density：

1.40±0.1 g/cm3

Melting Point：

232 °C

Boiling Point：

570.7±42.0 °C(Predicted)

PKA：

3.15±0.10

Safety Information

Hazard category：

IRRITANT

Marks：

Computed Properties

Molecular Weight:301.3
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:301.04087901
Monoisotopic Mass:301.04087901
Topological Polar Surface Area:84.8
Heavy Atom Count:21
Complexity:492
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(PHENYLSULFONYL)-1H-INDOLE-3-CARBOXYLICACID

Basic Attributes
Characteristics
Safety Information
Computed Properties

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