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1-[4-(METHYLSULFONYL)-2-NITROPHENYL]PIPERIDINE-3-CARBOXYLICACID

1-[4-(METHYLSULFONYL)-2-NITROPHENYL]PIPERIDINE-3-CARBOXYLICACID structure

CAS No:
951625-01-7
Formula:
C13H16N2O6S
Chemical Name:
1-[4-(METHYLSULFONYL)-2-NITROPHENYL]PIPERIDINE-3-CARBOXYLICACID
Synonyms:
1-[4-(METHYLSULFONYL)-2-NITROPHENYL]PIPERIDINE-3-CARBOXYLIC ACID;3-Piperidinecarboxylic acid, 1-[4-(methylsulfonyl)-2-nitrophenyl]-

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1-[4-(METHYLSULFONYL)-2-NITROPHENYL]PIPERIDINE-3-CARBOXYLICACID Basic Attributes

Molecular Weight：

328.34

Exact Mass：

328.07290741

Characteristics

Density：

1.442±0.06 g/cm3

Melting Point：

137-139°C

Boiling Point：

606.2±55.0 °C(Predicted)

PKA：

4.38±0.20

Safety Information

Hazard category：

IRRITANT

Marks：

Computed Properties

Molecular Weight:328.34
XLogP3:1.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:3
Exact Mass:328.07290741
Monoisotopic Mass:328.07290741
Topological Polar Surface Area:129
Heavy Atom Count:22
Complexity:538
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-[4-(METHYLSULFONYL)-2-NITROPHENYL]PIPERIDINE-3-CARBOXYLICACID

Basic Attributes
Characteristics
Safety Information
Computed Properties

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