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1899-24-7 | 2-Furancarboxaldehyde, 5-bromo-
CAS No: 1899-24-7 Catalog No: AG002E42 MDL No:MFCD00159501
Product Description
Catalog Number:
AG002E42
Chemical Name:
2-Furancarboxaldehyde, 5-bromo-
CAS Number:
1899-24-7
Molecular Formula:
C5H3BrO2
Molecular Weight:
174.9801
MDL Number:
MFCD00159501
IUPAC Name:
5-bromofuran-2-carbaldehyde
InChI:
InChI=1S/C5H3BrO2/c6-5-2-1-4(3-7)8-5/h1-3H
InChI Key:
WJTFHWXMITZNHS-UHFFFAOYSA-N
SMILES:
Brc1ccc(o1)C=O
Properties
Complexity:
94.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.932g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.981g/mol
Monoisotopic Mass:
173.932g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Literature
| Title | Journal |
|---|---|
| Association of Liver Injury From Specific Drugs, or Groups of Drugs, With Polymorphisms in HLA and Other Genes in a Genome-Wide Association Study. | Gastroenterology 20170401 |
| A novel HLA-A*3315 allele identified by haplotype-specific extraction and sequence-based typing. | Tissue antigens 20080701 |
| Identification of peptide vaccine candidates for prostate cancer patients with HLA-A3 supertype alleles. | Clinical cancer research : an official journal of the American Association for Cancer Research 20051001 |
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