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109347-40-2

109347-40-2 | (3-BROMOPHENYL)ACETALDEHYDE

CAS No: 109347-40-2 Catalog No: AG008S2V MDL No:MFCD02261727

Product Description

Catalog Number:
AG008S2V
Chemical Name:
(3-BROMOPHENYL)ACETALDEHYDE
CAS Number:
109347-40-2
Molecular Formula:
C8H7BrO
Molecular Weight:
199.0446
MDL Number:
MFCD02261727
IUPAC Name:
2-(3-bromophenyl)acetaldehyde
InChI:
InChI=1S/C8H7BrO/c9-8-3-1-2-7(6-8)4-5-10/h1-3,5-6H,4H2
InChI Key:
GQPCWVVXGHFKQY-UHFFFAOYSA-N
SMILES:
O=CCc1cccc(c1)Br

Properties

Complexity:
114  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.968g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
199.047g/mol
Monoisotopic Mass:
197.968g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

Literature

Title Journal
The diazo route to diazonamide A. Studies on the indole bis-oxazole fragment. The Journal of organic chemistry 20050902

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