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480438-64-0 | 3-PROPIONYLPHENYLBORONIC ACID
CAS No: 480438-64-0 Catalog No: AG00E78P MDL No:
Product Description
Catalog Number:
AG00E78P
Chemical Name:
3-PROPIONYLPHENYLBORONIC ACID
CAS Number:
480438-64-0
IUPAC Name:
(3-propanoylphenyl)boronic acid
InChI:
InChI=1S/C9H11BO3/c1-2-9(11)7-4-3-5-8(6-7)10(12)13/h3-6,12-13H,2H2,1H3
InChI Key:
HNEGUQPUGHVSEQ-UHFFFAOYSA-N
Properties
Complexity:
182
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.08g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
177.994g/mol
Monoisotopic Mass:
178.08g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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