Name: Name:1-Propanone, 2-bromo-1-tricyclo[3.3.1.13,7]dec-1-yl-
Brand: Angene
SKU: AG002TKG
Rating: 90 (10 reviews)

1-Propanone, 2-bromo-1-tricyclo[3.3.1.13,7]dec-1-yl-

CAS No.:

26525-24-6

Catalog Number:

AG002TKG

Molecular Formula:

C13H19BrO

Molecular Weight:

271.1934

Catalog Number:

AG002TKG

Chemical Name:

1-Propanone, 2-bromo-1-tricyclo[3.3.1.13,7]dec-1-yl-

CAS Number:

26525-24-6

Molecular Formula:

C13H19BrO

Molecular Weight:

271.1934

MDL Number:

MFCD01838121

IUPAC Name:

1-(1-adamantyl)-2-bromopropan-1-one

InChI:

InChI=1S/C13H19BrO/c1-8(14)12(15)13-5-9-2-10(6-13)4-11(3-9)7-13/h8-11H,2-7H2,1H3

InChI Key:

XABYMCZQJXPCLR-UHFFFAOYSA-N

SMILES:

CC(C(=O)C12CC3CC(C2)CC(C1)C3)Br

Complexity:

256

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

270.062g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

271.198g/mol

Monoisotopic Mass:

270.062g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

17.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.7