4-(2-Acetamido-4-fluoro-5-methylphenyl)butanoic Acid - CAS 182182-28-1
Catalog: |
BB013883 |
Product Name: |
4-(2-Acetamido-4-fluoro-5-methylphenyl)butanoic Acid |
CAS: |
182182-28-1 |
Synonyms: |
4-(2-acetamido-4-fluoro-5-methylphenyl)butanoic acid; 4-(2-acetamido-4-fluoro-5-methylphenyl)butanoic acid |
IUPAC Name: | 4-(2-acetamido-4-fluoro-5-methylphenyl)butanoic acid |
Description: | 4-(2-Acetamido-4-fluoro-5-methylphenyl)butanoic Acid (CAS# 182182-28-1 ) is a useful research chemical. |
Molecular Weight: | 253.27 |
Molecular Formula: | C13H16FNO3 |
Canonical SMILES: | CC1=C(C=C(C(=C1)CCCC(=O)O)NC(=O)C)F |
InChI: | InChI=1S/C13H16FNO3/c1-8-6-10(4-3-5-13(17)18)12(7-11(8)14)15-9(2)16/h6-7H,3-5H2,1-2H3,(H,15,16)(H,17,18) |
InChI Key: | WFFPQKXBJLTVSA-UHFFFAOYSA-N |
LogP: | 2.57280 |
Publication Number | Title | Priority Date |
EP-3677568-A1 | Novel method for producing antibody-drug conjugate | 20170831 |
US-2020384121-A1 | Novel method for producing antibody-drug conjugate | 20170831 |
CA-2213201-A1 | Aminatetralone derivatives and process for producing the same | 19950222 |
EA-000122-B1 | METHOD OF OBTAINING SUBSTITUTED DERIVATIVES OF BENZENE | 19950222 |
EP-0811603-A1 | Aminotetralone derivatives and process for producing the same | 19950222 |
Complexity: | 309 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 253.11142153 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 253.11142153 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 66.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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