Raptinal

CAT: 0607-BA2734-50Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0607-BA2734-50Size:50 mg

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CAS Number

1176-09-6

Form

A solid

Molecular Formula

C28H18O2

Molecular Weight

386.44

Shipping Conditions

Blue ice

Storage Conditions

-20°C.

Chemical Information

9H,9'H-(9,9'-bifluorene)-9,9'-dicarbaldehyde

CAS Number	1176-09-6
PubChem CID	355994
IUPAC Name	9-(9-formylfluoren-9-yl)fluorene-9-carbaldehyde
Molecular Formula	C28H18O2
Molecular Weight	386.4
XLogP	4.9
Topological Polar Surface Area	34.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Heavy Atom Count	30
Formal Charge	0
Complexity	580

SMILES

C1=CC=C2C(=C1)C3=CC=CC=C3C2(C=O)C4(C5=CC=CC=C5C6=CC=CC=C64)C=O

InChI

InChI=1S/C28H18O2/c29-17-27(23-13-5-1-9-19(23)20-10-2-6-14-24(20)27)28(18-30)25-15-7-3-11-21(25)22-12-4-8-16-26(22)28/h1-18H

InChIKey

GLANOOJJBKXTMI-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1176-09-6

CID: 355994

Formula: C28H18O2

MW: 386.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	386.4
XLogP3	4.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	386.130679813
Monoisotopic Mass	386.130679813
Topological Polar Surface Area	34.1 Å²
Heavy Atom Count	30
Formal Charge	0
Complexity	580
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

Catalog	Name
E1560-01	Raptinal
9652-5	EZSolution™ Raptinal