BHHT

CAT: 0498-bs-75936C-02Size: 500 mgDry Ice: NoHazardous: No

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CAT#:0498-bs-75936C-02Size:500 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

200862-69-7

Conjugation

Unconjugated

Buffer

Liquid

Solubility

Soluble in chloroform.

Smiles

FC(F)(F)C(F)(F)C(F)(F)C(=O)CC(=O)C1=CC=C(C=C1)C1=C(C=CC=C1)C1=CC=C(C=C1)C(=O)CC(=O)C(F)(F)C(F)(F)C(F)(F)F

Molecular Formula

C30H16F14O4

Molecular Weight

706.42

Storage Conditions

Stable for 2 years after receipt when stored at -20°C.

Chemical Information

4,4,5,5,6,6,6-Heptafluoro-1-[4-[2-[4-(4,4,5,5,6,6,6-heptafluoro-3-oxohexanoyl)phenyl]phenyl]phenyl]hexane-1,3-dione

CAS Number	200862-69-7
PubChem CID	23385999
IUPAC Name	4,4,5,5,6,6,6-heptafluoro-1-[4-[2-[4-(4,4,5,5,6,6,6-heptafluoro-3-oxohexanoyl)phenyl]phenyl]phenyl]hexane-1,3-dione
Molecular Formula	C30H16F14O4
Molecular Weight	706.4
XLogP	9.2
Topological Polar Surface Area	68.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	18
Rotatable Bond Count	12
Heavy Atom Count	48
Formal Charge	0
Complexity	1100

SMILES

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

InChI

InChI=1S/C30H16F14O4/c31-25(32,27(35,36)29(39,40)41)23(47)13-21(45)17-9-5-15(6-10-17)19-3-1-2-4-20(19)16-7-11-18(12-8-16)22(46)14-24(48)26(33,34)28(37,38)30(42,43)44/h1-12H,13-14H2

InChIKey

RNGCGRQNGQFBJS-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 200862-69-7

CID: 23385999

Formula: C30H16F14O4

MW: 706.4

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	706.4
XLogP3	9.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	18
Rotatable Bond Count	12
Exact Mass	706.0825033
Monoisotopic Mass	706.0825033
Topological Polar Surface Area	68.3 Å²
Heavy Atom Count	48
Formal Charge	0
Complexity	1100
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
GW6604-500mg	BHHT

BHHT

Chemical Information

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