2-(4-Methoxy-benzoylamino)-4-methyl-pentanoic acid

Base Information

• Chemical Name: 2-(4-Methoxy-benzoylamino)-4-methyl-pentanoic acid
• CAS No.: 438581-55-6
• Molecular Formula: C14H19 N O4 . Na
• Molecular Weight: 264.2976
• Hs Code.: 2924299090
• DSSTox Substance ID: DTXSID90389795
• ChEMBL ID: CHEMBL1514703
• Mol file: 438581-55-6.mol

Synonyms:438581-55-6;2-(4-Methoxy-benzoylamino)-4-methyl-pentanoic acid;2-[(4-methoxybenzoyl)amino]-4-methylpentanoic acid;2-(4-Methoxybenzamido)-4-methylpentanoic acid;(4-Methoxybenzoyl)leucine;TimTec1_007008;Oprea1_260287;Oprea1_301535;MLS002206395;CHEMBL1514703;DTXSID90389795;HMS1553O12;HMS2202P15;HMS3351I19;STL217581;N-[(4-methoxyphenyl)carbonyl]leucine;AKOS000130842;AKOS016338202;SMR001295212;CS-0357265;FT-0678377;2-(4-Methoxybenzamido)-4-methylpentanoicacid;2-(4-methoxybenzoylamino)-4-methylpentanoic acid;SR-01000370522;SR-01000370522-1;BRD-A20935429-001-01-1;L-Leucine,N-(4-methoxybenzoyl)-,monosodium salt(9ci)

Chemical Property of 2-(4-Methoxy-benzoylamino)-4-methyl-pentanoic acid

Chemical Property:

• Vapor Pressure: 1.09E-09mmHg at 25°C
• Boiling Point: 471.4 °C at 760 mmHg
• Flash Point: 238.9 °C
• PSA: 75.63000
• Density: g/cm³
• LogP: 2.31520
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 265.13140809
• Heavy Atom Count: 19
• Complexity: 309

Purity/Quality:

99% ^*data from raw suppliers

2-(4-Methoxy-benzoylamino)-4-methyl-pentanoic acid ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)CC(C(=O)O)NC(=O)C1=CC=C(C=C1)OC