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4-(4-cyanoanilino)-4-oxobutanoicacid

4-(4-cyanoanilino)-4-oxobutanoicacid structure

CAS No:
303213-70-9
Formula:
C11H10N2O3
Chemical Name:
4-(4-cyanoanilino)-4-oxobutanoicacid
Synonyms:
4-(4-cyanoanilino)-4-oxobutanoic acid;4-[(4-cyanophenyl)amino]-4-oxobutanoic acid;Butanoic acid, 4-[(4-cyanophenyl)amino]-4-oxo-

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4-(4-cyanoanilino)-4-oxobutanoicacid Basic Attributes

Molecular Weight：

218.21

Exact Mass：

218.06914219 g/mol

Characteristics

PSA：

90.2 Å²

Density：

1.32±0.1 g/cm3

Melting Point：

213-214 °C(Solv: water (7732-18-5))

Boiling Point：

540.1±35.0 °C(Predicted)

PKA：

4.53±0.10

Computed Properties

Molecular Weight:218.21
XLogP3:0.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:218.06914219
Monoisotopic Mass:218.06914219
Topological Polar Surface Area:90.2
Heavy Atom Count:16
Complexity:310
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: carbon disulfide; l methionine; pyrazine; calcium ammonium nitrate; 2 methyl 2 butene; oxalic acid formula

Guide of 4-(4-cyanoanilino)-4-oxobutanoicacid

Basic Attributes
Characteristics
Computed Properties

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