Name: Name:4-(2-bromoethyl)-2,2-difluoro-2H-1,3-benzodioxole
Brand: Angene
SKU: AG01C2KA
Rating: 90 (10 reviews)

4-(2-bromoethyl)-2,2-difluoro-2H-1,3-benzodioxole

CAS No.:

531508-36-8

Catalog Number:

AG01C2KA

Molecular Formula:

C9H7BrF2O2

Molecular Weight:

265.0515

Catalog Number:

AG01C2KA

Chemical Name:

4-(2-bromoethyl)-2,2-difluoro-2H-1,3-benzodioxole

CAS Number:

531508-36-8

Molecular Formula:

C9H7BrF2O2

Molecular Weight:

265.0515

MDL Number:

MFCD30178358

IUPAC Name:

4-(2-bromoethyl)-2,2-difluoro-1,3-benzodioxole

InChI:

InChI=1S/C9H7BrF2O2/c10-5-4-6-2-1-3-7-8(6)14-9(11,12)13-7/h1-3H,4-5H2

InChI Key:

JYEQNJYUQHXXBG-UHFFFAOYSA-N

SMILES:

BrCCc1cccc2c1OC(O2)(F)F

Complexity:

213

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

263.96g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

265.054g/mol

Monoisotopic Mass:

263.96g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

18.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.5