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1242057-00-6

1242057-00-6 | Boron, difluoro[methyl 5-[(3,5-dimethyl-2H-pyrrol-2-ylidene-κN)methyl]-1H-pyrrole-2-propanoato-κN1]-, (T-4)-

CAS No: 1242057-00-6 Catalog No: AG000LN9 MDL No:

Product Description

Catalog Number:
AG000LN9
Chemical Name:
Boron, difluoro[methyl 5-[(3,5-dimethyl-2H-pyrrol-2-ylidene-κN)methyl]-1H-pyrrole-2-propanoato-κN1]-, (T-4)-
CAS Number:
1242057-00-6
IUPAC Name:
methyl 3-(2,2-difluoro-10,12-dimethyl-1-aza-3-azonia-2-boranuidatricyclo[7.3.0.03,7]dodeca-3,5,7,9,11-pentaen-4-yl)propanoate
InChI:
InChI=1S/C15H17BF2N2O2/c1-10-8-11(2)19-14(10)9-13-5-4-12(6-7-15(21)22-3)20(13)16(19,17)18/h4-5,8-9H,6-7H2,1-3H3
InChI Key:
YKZNONDRHXQSKM-UHFFFAOYSA-N

Properties

Complexity:
600  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.135g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
306.12g/mol
Monoisotopic Mass:
306.135g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
34.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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