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1-(4-METHYL-BENZYL)-5-OXO-PYRROLIDINE-3-CARBOXYLICACID

1-(4-METHYL-BENZYL)-5-OXO-PYRROLIDINE-3-CARBOXYLICACID structure

CAS No:
96449-91-1
Formula:
C13H15NO3
Chemical Name:
1-(4-METHYL-BENZYL)-5-OXO-PYRROLIDINE-3-CARBOXYLICACID
Synonyms:
CHEMBRDG-BB 4024758;1-(4-METHYL-BENZYL)-5-OXO-PYRROLIDINE-3-CARBOXYLIC ACID;AKOS BC-2629;1-[(4-chlorophenyl)methyl]-5-pyrrolidine-3-carboxylic acid;Albb-007186;1-(4-methylbenzyl)-5-oxopyrrolidine-3-carboxylic acid(SALTDATA: FREE);1-(4-methylbenzyl)-5-oxo-3-pyrrolidinecarboxylic acid;1-[(4-methylphenyl)methyl]-5-oxo-3-pyrrolidinecarboxylic acid

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1-(4-METHYL-BENZYL)-5-OXO-PYRROLIDINE-3-CARBOXYLICACID Basic Attributes

Molecular Weight：

233.26

Exact Mass：

233.10519334

DSSTox ID：

DTXSID10372442

HScode：

2933790090

Characteristics

PSA：

57.61000

XLogP3：

1.36600

Density：

1.273g/cm3

Boiling Point：

478.7ºC

Flash Point：

243.3ºC

Refractive Index：

1.595

Safety Information

Hazard category：

IRRITANT

hazard class code：

safety instructions：

Marks：

Computed Properties

Molecular Weight:233.26
XLogP3:0.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:233.10519334
Monoisotopic Mass:233.10519334
Topological Polar Surface Area:57.6
Heavy Atom Count:17
Complexity:308
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: carbon tetrabromide; copper i oxide; formula sodium hypochlorite; bromide formula; sulfite formula; 1 3 bisphosphoglycerate

Guide of 1-(4-METHYL-BENZYL)-5-OXO-PYRROLIDINE-3-CARBOXYLICACID

Basic Attributes
Characteristics
Safety Information
Computed Properties

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