Compound Fr16675

CAT: 0013-GTR19270148-01Size: 1 mgDry Ice: NoHazardous: No

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CAT#:0013-GTR19270148-01Size:1 mg

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Description

Compound Fr16675, with CAS No. 78348-24-0, is a fragment molecule that serves as an important scaffold for molecular linking, expansion, and modification. Compound Fr16675 provides a structural basis and research tool for the design and screening of novel drug candidates, and is commonly used in drug discovery, drug synthesis, and related research.

CAS Number

78348-24-0

Smiles

OC (=O) C1Cc2ccccc2N1

Molecular Formula

C9H9NO2

Molecular Weight

163.18

Storage Conditions

-20°C

Notes

For research use only.

Chemical Information

Indoline-2-carboxylic acid

Indoline-2-carboxylic acid is a member of indoles and a monocarboxylic acid.

CAS Number	78348-24-0
PubChem CID	86074
IUPAC Name	2,3-dihydro-1H-indole-2-carboxylic acid
Molecular Formula	C9H9NO2
Molecular Weight	163.17
XLogP	1.6
Topological Polar Surface Area	49.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	12
Formal Charge	0
Complexity	193

SMILES

C1C(NC2=CC=CC=C21)C(=O)O

InChI

InChI=1S/C9H9NO2/c11-9(12)8-5-6-3-1-2-4-7(6)10-8/h1-4,8,10H,5H2,(H,11,12)

InChIKey

QNRXNRGSOJZINA-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 78348-24-0

CID: 86074

Formula: C9H9NO2

MW: 163.17

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	163.17
XLogP3	1.6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	163.063328530
Monoisotopic Mass	163.063328530
Topological Polar Surface Area	49.3 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	193
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
GTR19270145-01	Compound Fr16670
GTR19269952	Compound Fr13675
GTR19270139-01	Compound Fr16645
GTR19270154-01	Compound Fr16693
GTR19270149-01	Compound Fr16681
GTR19269817-01	Compound Fr12575
GTR19270156-01	Compound Fr16705
GTR19270152-01	Compound Fr16687
GTR19270150-01	Compound Fr16684
GTR19270144-01	Compound Fr16663

Alternative Products

Catalog	Name
ALX-550-516-M025	Compound A
C8444-50	Compound C108
C5824-10	GPR120 Compound A
A8197-5.1	Compound 56
B7337-5	Compound 401
XXC35825-01	Compound 3a
Fr16729-01	Compound Fr16729
PDK0296-01	Compound PDK0296
PDK0264-01	Compound PDK0264
Fr14090-01	Compound Fr14090

Compound Fr16675

Chemical Information

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