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Home > Boronic Acids > 290348-01-5
290348-01-5 | (3-isopropyl-4-methoxyphenyl)boronic acid
CAS No: 290348-01-5 Catalog No: AG01DDXQ MDL No:MFCD22414591
Product Description
Catalog Number:
AG01DDXQ
Chemical Name:
(3-isopropyl-4-methoxyphenyl)boronic acid
CAS Number:
290348-01-5
Molecular Formula:
C10H15BO3
Molecular Weight:
194.0353
MDL Number:
MFCD22414591
IUPAC Name:
(4-methoxy-3-propan-2-ylphenyl)boronic acid
InChI:
InChI=1S/C10H15BO3/c1-7(2)9-6-8(11(12)13)4-5-10(9)14-3/h4-7,12-13H,1-3H3
InChI Key:
ILKURCOQRCUYRU-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1C(C)C)B(O)O
Properties
Complexity:
173
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.111g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
194.037g/mol
Monoisotopic Mass:
194.111g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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