PEO-IAA 50mg

CAT: 0628-A19478-50Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0628-A19478-50Size:50 mg

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CAS Number

6266-66-6

Chemical Information

2-(1H-Indol-3-yl)-4-oxo-4-phenylbutanoic acid

CAS Number	6266-66-6
PubChem CID	235453
IUPAC Name	2-(1H-indol-3-yl)-4-oxo-4-phenylbutanoic acid
Molecular Formula	C18H15NO3
Molecular Weight	293.3
XLogP	2.9
Topological Polar Surface Area	70.2
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Heavy Atom Count	22
Formal Charge	0
Complexity	417

SMILES

C1=CC=C(C=C1)C(=O)CC(C2=CNC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C18H15NO3/c20-17(12-6-2-1-3-7-12)10-14(18(21)22)15-11-19-16-9-5-4-8-13(15)16/h1-9,11,14,19H,10H2,(H,21,22)

InChIKey

SJVMWLJNHPHNPT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 6266-66-6

CID: 235453

Formula: C18H15NO3

MW: 293.3

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	293.3
XLogP3	2.9
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Exact Mass	293.10519334
Monoisotopic Mass	293.10519334
Topological Polar Surface Area	70.2 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	417
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

Catalog	Name
MBS3608915-01	PEO-IAA
DC76066	IAA
FB52768-01	(+) -Biotin- (PEO) 4-amine
288063-01	(PEO) 4-bis-amine
sc-470524A	(+) -Biotin- (PEO) 3-iodoacetamide
265977-01	(+) -Biotin- (PEO) 3-amine
265976-01	(+) -Biotin- (PEO) 4-psoralen
235530	(+) -Biotin- (PEO) 3-fluorescein
TRC-T898215-25MG	Tylophorinidine-PEO Acetal Conjugate
sc-507259	(+) -Biotin- (PEO) 3-maleimide