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Home > Boronic Acids > 1256345-78-4

1256345-78-4

1256345-78-4 | Boronic acid, B-[3-(cyclopropylmethoxy)-5-methylphenyl]-

CAS No: 1256345-78-4 Catalog No: AG000O11 MDL No:MFCD17015733

Product Description

Catalog Number:
AG000O11
Chemical Name:
Boronic acid, B-[3-(cyclopropylmethoxy)-5-methylphenyl]-
CAS Number:
1256345-78-4
Molecular Formula:
C11H15BO3
Molecular Weight:
206.0460
MDL Number:
MFCD17015733
IUPAC Name:
[3-(cyclopropylmethoxy)-5-methylphenyl]boronic acid
InChI:
InChI=1S/C11H15BO3/c1-8-4-10(12(13)14)6-11(5-8)15-7-9-2-3-9/h4-6,9,13-14H,2-3,7H2,1H3
InChI Key:
TXNOKFVUGUTVIN-UHFFFAOYSA-N
SMILES:
Cc1cc(OCC2CC2)cc(c1)B(O)O

Properties

Complexity:
206  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.111g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
206.048g/mol
Monoisotopic Mass:
206.111g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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