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26110-32-7
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Basic Information
CAS No.: 26110-32-7
Name: 2'-Chloro-5'-[4-(2,4-di-tert-pentylphenoxy)butyrylamino]-4,4-dimethyl-3-oxopentananilide
Molecular Structure:
Molecular Structure of 26110-32-7 (2'-Chloro-5'-[4-(2,4-di-tert-pentylphenoxy)butyrylamino]-4,4-dimethyl-3-oxopentananilide)
Formula: C33H47ClN2O4
Molecular Weight: 571.2
Synonyms: Valeranilide,2'-chloro-5'-[4-(2,4-di-tert-pentylphenoxy)butyramido]-4,4-dimethyl-3-oxo-(7CI,8CI);a-Pivalyl-2-chloro-5-[g-(2,4-di-tert-amylphenoxy)butyramido]acetanilide;
EINECS: 247-463-7
Density: 1.109g/cm3
Boiling Point: 714.5°Cat760mmHg
Flash Point: 385.9°C
PSA: 84.50000
LogP: 8.60270
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Chemistry

IUPAC Name: N-[5-[4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanoylamino]-2-chlorophenyl]-4,4-dimethyl-3-oxopentanamide 
Empirical Formula: C33H47ClN2O4
Molecular Weight: 571.1903 
EINECS: 247-463-7 
Structure of Pentanamide,N-[5-[[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]-1-oxobutyl]amino]-2-chlorophenyl]-4,4-dimethyl-3-oxo- (CAS NO.26110-32-7):

Index of Refraction: 1.551
Molar Refractivity: 164.4 cm3
Molar Volume: 515 cm3
Polarizability: 65.17×10-24cm3
Surface Tension: 40.2 dyne/cm
Density: 1.109 g/cm3
Flash Point: 385.9 °C
Enthalpy of Vaporization: 104.44 kJ/mol
Boiling Point: 714.5 °C at 760 mmHg
Vapour Pressure: 2.91E-20 mmHg at 25°C 
Synonyms of Pentanamide,N-[5-[[4-[2,4-bis(1,1-dimethylpropyl)phenoxy]-1-oxobutyl]amino]-2-chlorophenyl]-4,4-dimethyl-3-oxo- (CAS NO.26110-32-7): N-(2-(Chloro-5-(4-(2,4-di-tert-pentylphenoxy)butyramido)phenyl)-4,4-dimethyl-3-oxopentanamide
Canonical SMILES: CCC(C)(C)C1=CC(=C(C=C1)OCCCC(=O)NC2=CC(=C(C=C2)Cl)NC(=O)CC(=O)C(C)(C)C)C
(C)(C)CC
InChI: InChI=1S/C33H47ClN2O4/c1-10-32(6,7)22-14-17-27(24(19-22)33(8,9)11-2)40-18-12-13-29(38)35-23-15-16-25(34)26(20-23)36-30(39)21-28(37)31(3,4)5/h14-17,19-20H,10-13,18,21H2,1-9H3,(H,35,38)(H,36,39)
InChIKey: ITHPSMPRJDBHIR-UHFFFAOYSA-N