GEBR-7b

CAT: 0127-BUP10625-06Size: 200 mgDry Ice: NoHazardous: No

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CAT#:0127-BUP10625-06Size:200 mg

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CAS Number

67387-76-2

Synonyms

3- (Cyclopentyloxy) -4-methoxybenzaldehyde

Purity

=98%

Smiles

COC1=C(OC2CCCC2)C=C(C=O)C=C1

Chemical Information

3-Cyclopentyloxy-4-methoxybenzaldehyde

structure in first source

CAS Number	67387-76-2
PubChem CID	2735893
IUPAC Name	3-cyclopentyloxy-4-methoxybenzaldehyde
Molecular Formula	C13H16O3
Molecular Weight	220.26
XLogP	2.6
Topological Polar Surface Area	35.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Heavy Atom Count	16
Formal Charge	0
Complexity	223

SMILES

COC1=C(C=C(C=C1)C=O)OC2CCCC2

InChI

InChI=1S/C13H16O3/c1-15-12-7-6-10(9-14)8-13(12)16-11-4-2-3-5-11/h6-9,11H,2-5H2,1H3

InChIKey

FZFWPURYSWKIRT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 67387-76-2

CID: 2735893

Formula: C13H16O3

MW: 220.26

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	220.26
XLogP3	2.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	220.109944368
Monoisotopic Mass	220.109944368
Topological Polar Surface Area	35.5 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	223
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
OR1029669-01	Sudan Red 7B
OR1101846-01	(1aR,7bS) -4- (Benzylthio) -5-methoxy-1,1a,2,7b-tetrahydrocyclopropa[c]chromene
PC421204	2,5-Difluoro-1a,7,7a,7b-tetrahydro-2H-oxireno[2,3-c]chromene
OR1101622	N, N'-[ (7S,7bR,8aS,8bS,9aR,10S,16cS,16dR,16eR,16fS) -5,6,7,7b,8,8a,8b,9,9a,10,11,12,16c,16d,16e,16f-Hexadecahydro-1,2,3,8a,8b,14,15,16-octamethoxy-8,9-dioxobisbenzo[3',4']cyclohepta[1',2':3,4]cyclobuta[1,2-c:1',2'-c']cyclobuta[1,2-a:4,3-a']dicyclopente

Catalog	Name
M27181-01	GEBR-7b
217632	PDE4D Inhibitor, GEBR-7b ((E) -3- (cyclopentyloxy) -4-methoxybenzaldehyde, O-2- (2,6-dimethylmorpholino) -2-oxoethyl oxime, GEBR-7b)
217631	PDE4D Inhibitor, GEBR-7b ((E) -3- (cyclopentyloxy) -4-methoxybenzaldehyde, O-2- (2,6-dimethylmorpholino) -2-oxoethyl oxime, GEBR-7b) discontinued
TRC-F862495-1MG	7b-Fulvestrant
ARC0491	MCF-7B
289173-01	7b-Spironolactone
MBS7198516	7b Antibody
485758	METTL7B (Methyltransferase-Like Protein 7B, Methyltransferase Like 7B)
474672	ACTL7B (Actin-Like Protein 7B, Actin-Like 7B)
MBS1237188-01	Recombinant Alopias vulpinus Protein Wnt-7b (WNT-7B)