Name: Name:3-(1,1,2,3,3,3-HEXAFLUOROPROPYL)ADAMANTANE-1-CARBOXYLIC ACID
Brand: Angene
SKU: AG004RJ1
Rating: 90 (10 reviews)

3-(1,1,2,3,3,3-HEXAFLUOROPROPYL)ADAMANTANE-1-CARBOXYLIC ACID

CAS No.:

86301-98-6

Catalog Number:

AG004RJ1

Molecular Formula:

C14H16F6O2

Molecular Weight:

330.2661

Catalog Number:

AG004RJ1

Chemical Name:

3-(1,1,2,3,3,3-HEXAFLUOROPROPYL)ADAMANTANE-1-CARBOXYLIC ACID

CAS Number:

86301-98-6

Molecular Formula:

C14H16F6O2

Molecular Weight:

330.2661

MDL Number:

MFCD00193108

IUPAC Name:

3-(1,1,2,3,3,3-hexafluoropropyl)adamantane-1-carboxylic acid

InChI:

InChI=1S/C14H16F6O2/c15-9(14(18,19)20)13(16,17)12-4-7-1-8(5-12)3-11(2-7,6-12)10(21)22/h7-9H,1-6H2,(H,21,22)

InChI Key:

GLJDZZQQPFAEPQ-UHFFFAOYSA-N

SMILES:

FC(C(C12CC3CC(C1)CC(C2)(C3)C(=O)O)(F)F)C(F)(F)F

Complexity:

486

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

330.105g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

330.27g/mol

Monoisotopic Mass:

330.105g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

37.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.1