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Home > Boronic Acids > 112238-06-9
112238-06-9 | 1H-Borole, 2,5-dihydro-3,4-dimethyl-1-phenyl-
CAS No: 112238-06-9 Catalog No: AG007BSY MDL No:
Product Description
Catalog Number:
AG007BSY
Chemical Name:
1H-Borole, 2,5-dihydro-3,4-dimethyl-1-phenyl-
CAS Number:
112238-06-9
Molecular Formula:
C12H15B
Molecular Weight:
170.0585
IUPAC Name:
3,4-dimethyl-1-phenyl-2,5-dihydroborole
InChI:
InChI=1S/C12H15B/c1-10-8-13(9-11(10)2)12-6-4-3-5-7-12/h3-7H,8-9H2,1-2H3
InChI Key:
RJEWGMKPLOLPAW-UHFFFAOYSA-N
SMILES:
CC1=C(C)CB(C1)c1ccccc1
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.127g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.062g/mol
Monoisotopic Mass:
170.127g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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