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Home > Boronic Acids > 1182283-83-5
1182283-83-5 | (4-(3-chloropropoxy)phenyl)boronic acid
CAS No: 1182283-83-5 Catalog No: AG0095HX MDL No:MFCD28384317
Product Description
Catalog Number:
AG0095HX
Chemical Name:
(4-(3-chloropropoxy)phenyl)boronic acid
CAS Number:
1182283-83-5
Molecular Formula:
C9H12BClO3
Molecular Weight:
214.4538
MDL Number:
MFCD28384317
IUPAC Name:
[4-(3-chloropropoxy)phenyl]boronic acid
InChI:
InChI=1S/C9H12BClO3/c11-6-1-7-14-9-4-2-8(3-5-9)10(12)13/h2-5,12-13H,1,6-7H2
InChI Key:
QEPYXWNDHGBFQI-UHFFFAOYSA-N
SMILES:
ClCCCOc1ccc(cc1)B(O)O
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.057g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
214.452g/mol
Monoisotopic Mass:
214.057g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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