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sodium,7-[4-(2-fluorophenyl)-2-propan-2-ylquinolin-3-yl]-3,5-dihydroxyhept-6-enoate

sodium,7-[4-(2-fluorophenyl)-2-propan-2-ylquinolin-3-yl]-3,5-dihydroxyhept-6-enoate structure

CAS No:
121661-23-2
Formula:
C25H25FNNaO4
Chemical Name:
sodium,7-[4-(2-fluorophenyl)-2-propan-2-ylquinolin-3-yl]-3,5-dihydroxyhept-6-enoate
Synonyms:
6-Heptenoicacid,7-[4-(2-fluorophenyl)-2-(1-methylethyl)-3-quinolinyl]-3,5-dihydroxy-,monosodium salt (9CI); SODIUM (E)-7-[4-(2-FLUOROPHENYL)-2-PROPAN-2-YL-(QUINOLIN-3-YL)]-3,5-DIHYDROXY-HEPT-6-ENOATE; 6-Heptenoic acid,7-[4-(2-fluorophenyl)-2-(1-methylethyl)-3-quinolinyl]-3,5-dihydroxy-,sodiumsalt (1:1);

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sodium,7-[4-(2-fluorophenyl)-2-propan-2-ylquinolin-3-yl]-3,5-dihydroxyhept-6-enoate Basic Attributes

Molecular Weight：

445.45800

Exact Mass：

445.16653072

Characteristics

PSA：

93.48000

XLogP3：

3.42940

Boiling Point：

664.9ºC at 760mmHg

Flash Point：

355.9ºC

Vapor Pressure：

1.39E-18mmHg at 25°C

Computed Properties

Molecular Weight:445.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:445.16653072
Monoisotopic Mass:445.16653072
Topological Polar Surface Area:93.5
Heavy Atom Count:32
Complexity:619
Undefined Atom Stereocenter Count:2
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of sodium,7-[4-(2-fluorophenyl)-2-propan-2-ylquinolin-3-yl]-3,5-dihydroxyhept-6-enoate

Basic Attributes
Characteristics
Computed Properties

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