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Home > Boronic Acids > 1296671-86-7
1296671-86-7 | Boronic acid, B-[3-(pentyloxy)phenyl]-
CAS No: 1296671-86-7 Catalog No: AG000TKP MDL No:MFCD11183197
Product Description
Catalog Number:
AG000TKP
Chemical Name:
Boronic acid, B-[3-(pentyloxy)phenyl]-
CAS Number:
1296671-86-7
Molecular Formula:
C11H17BO3
Molecular Weight:
208.0619
MDL Number:
MFCD11183197
IUPAC Name:
(3-pentoxyphenyl)boronic acid
InChI:
InChI=1S/C11H17BO3/c1-2-3-4-8-15-11-7-5-6-10(9-11)12(13)14/h5-7,9,13-14H,2-4,8H2,1H3
InChI Key:
UMEOKJGUOUIZBL-UHFFFAOYSA-N
SMILES:
CCCCCOc1cccc(c1)B(O)O
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.127g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
208.064g/mol
Monoisotopic Mass:
208.127g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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