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93296-26-5

93296-26-5 | 3-Borabicyclo[3.3.1]non-6-ene, 3-methoxy-7-(2-thienylmethyl)-

CAS No: 93296-26-5 Catalog No: AG0064F0 MDL No:

Product Description

Catalog Number:
AG0064F0
Chemical Name:
3-Borabicyclo[3.3.1]non-6-ene, 3-methoxy-7-(2-thienylmethyl)-
CAS Number:
93296-26-5
Molecular Formula:
C14H19BOS
Molecular Weight:
246.1761
IUPAC Name:
2-[(3-methoxy-3-borabicyclo[3.3.1]non-6-en-7-yl)methyl]thiophene
InChI:
InChI=1S/C14H19BOS/c1-16-15-9-12-5-11(6-13(7-12)10-15)8-14-3-2-4-17-14/h2-5,12-13H,6-10H2,1H3
InChI Key:
AVEFQHRLYVHUBN-UHFFFAOYSA-N
SMILES:
COB1CC2CC(C1)C=C(C2)Cc1cccs1

Properties

Complexity:
305  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.125g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
246.175g/mol
Monoisotopic Mass:
246.125g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
37.5A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0

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