Fmoc-2-amino-5-bromobenzoic acid - CAS 183871-04-7
Catalog: |
BB014104 |
Product Name: |
Fmoc-2-amino-5-bromobenzoic acid |
CAS: |
183871-04-7 |
Synonyms: |
5-bromo-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]benzoic acid; 5-bromo-2-(9H-fluoren-9-ylmethoxycarbonylamino)benzoic acid |
IUPAC Name: | 5-bromo-2-(9H-fluoren-9-ylmethoxycarbonylamino)benzoic acid |
Description: | Fmoc-2-amino-5-bromobenzoic acid (CAS# 183871-04-7) is a useful research chemical compound. |
Molecular Weight: | 438.27 |
Molecular Formula: | C22H16BrNO4 |
Canonical SMILES: | C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NC4=C(C=C(C=C4)Br)C(=O)O |
InChI: | InChI=1S/C22H16BrNO4/c23-13-9-10-20(18(11-13)21(25)26)24-22(27)28-12-19-16-7-3-1-5-14(16)15-6-2-4-8-17(15)19/h1-11,19H,12H2,(H,24,27)(H,25,26) |
InChI Key: | DJPIQOAAQHUHOB-UHFFFAOYSA-N |
MDL: | MFCD02682151 |
LogP: | 5.58130 |
Complexity: | 563 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 437.02627 |
Formal Charge: | 0 |
Heavy Atom Count: | 28 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 437.02627 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 75.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 5.4 |
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