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1-[4-(METHYLSULFONYL)-2-NITROPHENYL]PYRROLIDINE-2-CARBOXYLICACID

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

CAS No:
93001-20-8
Formula:
C12H14N2O6S
Chemical Name:
1-[4-(METHYLSULFONYL)-2-NITROPHENYL]PYRROLIDINE-2-CARBOXYLICACID
Synonyms:
1-[4-(Methylsulfonyl)-2-nitrophenyl]pyrrolidine-2-;1-(4-Methylsulfonyl-4-nitrophenyl)pyrrolidine-2-carboxylicacid;1-[4-(METHYLSULFONYL)-2-NITROPHENYL]PYRROLIDINE-2-CARBOXYLIC ACID;4-(2-Carboxypyrrolidin-1-yl)-3-nitrophenyl methyl sulphone, 1-[4-(Methylsulphonyl)-2-nitrophenyl]-DL-proline

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

Molecular Weight：

314.31400

Exact Mass：

314.05700

DSSTox ID：

DTXSID00656046

HScode：

2933990090

Characteristics

PSA：

128.88000

XLogP3：

2.72070

Density：

1.497g/cm3

Melting Point：

173-174ºC

Boiling Point：

603ºC at 760mmHg

Flash Point：

318.5ºC

Refractive Index：

1.611

Safety Information

Marks：

Xi: Irritant;

Computed Properties

Molecular Weight:314.32
XLogP3:1.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:3
Exact Mass:314.05725734
Monoisotopic Mass:314.05725734
Topological Polar Surface Area:129
Heavy Atom Count:21
Complexity:523
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]PYRROLIDINE-2-CARBOXYLICACID

Basic Attributes
Characteristics
Safety Information
Computed Properties

1-[4-(METHYLSULFONYL)-2-NITROPHENYL]PYRROLIDINE-2-CARBOXYLICACID

SDS

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