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411229-76-0

411229-76-0 | (3-(Cyclopropylmethoxy)phenyl)boronic acid

CAS No: 411229-76-0 Catalog No: AG0038QN MDL No:MFCD04039016

Product Description

Catalog Number:
AG0038QN
Chemical Name:
(3-(Cyclopropylmethoxy)phenyl)boronic acid
CAS Number:
411229-76-0
Molecular Formula:
C10H13BO3
Molecular Weight:
192.0194
MDL Number:
MFCD04039016
IUPAC Name:
[3-(cyclopropylmethoxy)phenyl]boronic acid
InChI:
InChI=1S/C10H13BO3/c12-11(13)9-2-1-3-10(6-9)14-7-8-4-5-8/h1-3,6,8,12-13H,4-5,7H2
InChI Key:
JKQCWRCXYIUCCN-UHFFFAOYSA-N
SMILES:
OB(c1cccc(c1)OCC1CC1)O

Properties

Complexity:
182  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.096g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
192.021g/mol
Monoisotopic Mass:
192.096g/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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