CIT-ALD

CAT: 0931-TYD-02191-02Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0931-TYD-02191-02Size:50 mg

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

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CAS Number

211800-31-6

Target

Drug Metabolite

Related Pathways

Metabolism

Bioactivity

CIT-ALD is an aldehyde intermediate formed during the metabolism of Citalopram. It has potential applications in the research of neurological disorders.

Smiles

N#CC1=CC=C2C(=C1)COC2(C3=CC=C(F)C=C3)CCC=O

Molecular Formula

C18H14FNO2

Molecular Weight

295.31

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Citalopram aldehyde

Citalopram aldehyde is a nitrile and a member of benzenes.

CAS Number	211800-31-6
PubChem CID	9944000
IUPAC Name	1-(4-fluorophenyl)-1-(3-oxopropyl)-3H-2-benzofuran-5-carbonitrile
Molecular Formula	C18H14FNO2
Molecular Weight	295.3
XLogP	2.3
Topological Polar Surface Area	50.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Heavy Atom Count	22
Formal Charge	0
Complexity	451

SMILES

C1C2=C(C=CC(=C2)C#N)C(O1)(CCC=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H14FNO2/c19-16-5-3-15(4-6-16)18(8-1-9-21)17-7-2-13(11-20)10-14(17)12-22-18/h2-7,9-10H,1,8,12H2

InChIKey

BBYAFETUIKMLSF-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 211800-31-6

CID: 9944000

Formula: C18H14FNO2

MW: 295.3

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	295.3
XLogP3	2.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Exact Mass	295.10085685
Monoisotopic Mass	295.10085685
Topological Polar Surface Area	50.1 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	451
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Related Products

Catalog	Name
T29848-01	ALD-52
TCL-00088-01	4A3-Cit
T18868-01	Val-Cit
T38721-01	ALD-PEG4-OPFP
T38853-01	Methyl-PEG3-Ald
T87778-01	Ald-PEG23-SPDP
T87886-01	CBu-Cit-OH
T26779-01	Beta-CIT-FP
T14155-01	Ald-C2-PEG4-azide
T14159-01	Ald-CH2-PEG5-azide

Alternative Products

Catalog	Name
HY-172985	CIT-ALD
14000396	ALD
YP-W16275-01	Human ALD (ALD) ELISA Kit
YP-W71324-01	Porcine ALD (ALD) ELISA Kit
YP-W22179-01	Mouse ALD (ALD) ELISA Kit
HY-138218	ALD-52
RM-F131550-01	Fmoc- D-Cit - D-Cit -Oh
HY-136127	ALD-PEG4-OPFP
506425	ABCD1 (ALD) discontinued
EKN54052	ALD CLIA Kit

CIT-ALD

Chemical Information

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