Name: Name:1',4'-dibromospiro[1,3-dioxolane-2,10'-tricyclo[5.2.1.0,2,6]decane]-3',8'-dien-5'-one
Brand: Angene
SKU: AG019WBB
Rating: 90 (10 reviews)

1',4'-dibromospiro[1,3-dioxolane-2,10'-tricyclo[5.2.1.0,2,6]decane]-3',8'-dien-5'-one

CAS No.:

95272-45-0

Catalog Number:

AG019WBB

Molecular Formula:

C12H10Br2O3

Molecular Weight:

362.0140

Catalog Number:

AG019WBB

Chemical Name:

1',4'-dibromospiro[1,3-dioxolane-2,10'-tricyclo[5.2.1.0,2,6]decane]-3',8'-dien-5'-one

CAS Number:

95272-45-0

Molecular Formula:

C12H10Br2O3

Molecular Weight:

362.0140

MDL Number:

MFCD00498143

IUPAC Name:

4',7'-dibromospiro[1,3-dioxolane-2,10'-tricyclo[5.2.1.02,6]deca-4,8-diene]-3'-one

InChI:

InChI=1S/C12H10Br2O3/c13-8-5-7-9(10(8)15)6-1-2-11(7,14)12(6)16-3-4-17-12/h1-2,5-7,9H,3-4H2

InChI Key:

CWLJXBQYHGTEDC-UHFFFAOYSA-N

SMILES:

BrC1=CC2C(C1=O)C1C3(C2(Br)C=C1)OCCO3

Complexity:

478

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

361.898g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

362.017g/mol

Monoisotopic Mass:

359.9g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

35.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6