Nebivolol Impurity 118

CAT: 1299-RM-N022318-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-N022318-01Size:10 mg

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CAS Number

93340-05-7

Synonyms

8-fluorochromane-2-carboxylic acid

Molecular Formula

C10H9FO3

Molecular Weight

196.18

Target Alternative Name

Nebivolol

Product Name Synonym

8-fluorochromane-2-carboxylic acid

Chemical Information

8-Fluorochromane-2-carboxylic acid

CAS Number	93340-05-7
PubChem CID	69193596
IUPAC Name	8-fluoro-3,4-dihydro-2H-chromene-2-carboxylic acid
Molecular Formula	C10H9FO3
Molecular Weight	196.17
XLogP	2
Topological Polar Surface Area	46.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Heavy Atom Count	14
Formal Charge	0
Complexity	231

SMILES

C1CC2=C(C(=CC=C2)F)OC1C(=O)O

InChI

InChI=1S/C10H9FO3/c11-7-3-1-2-6-4-5-8(10(12)13)14-9(6)7/h1-3,8H,4-5H2,(H,12,13)

InChIKey

VUJQGOUUSZRRMZ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 93340-05-7

CID: 69193596

Formula: C10H9FO3

MW: 196.17

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	196.17
XLogP3	2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	196.05357231
Monoisotopic Mass	196.05357231
Topological Polar Surface Area	46.5 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	231
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
RM-N022220-01	Nebivolol Impurity 20 (Srrs-Nebivolol)
RM-N022219-01	Nebivolol Impurity 19 (Rrrr-Nebivolol)
RM-N022211-01	Nebivolol Impurity 11 (Rrsr-Nebivolol)
RM-N022235-01	Nebivolol Impurity 35 (Ssss-Nebivolol)
RM-N022291-01	Nebivolol Impurity 91 (Srss-Nebivolol Hcl)
RM-N022294-01	Nebivolol Impurity 94
RM-N022290-01	Nebivolol Impurity 90
RM-N022274-01	Nebivolol Impurity 74
RM-N022319-01	Nebivolol Impurity 119
RM-N022317-01	Nebivolol Impurity 117

Catalog	Name
AR-N01217-01	Nebivolol Impurity 26
AR-N01222-01	Nebivolol Impurity 25
AR-N01195-01	Nebivolol Impurity 4
TRC-N387990-10MG	Nebivolol Impurity B
AR-N01194-01	Nebivolol Impurity 3
AR-N01196-01	Nebivolol Impurity 5
AR-N01221-01	Nebivolol Impurity 24
AR-N00991-01	Nebivolol Impurity Isomer A
AR-N08113-01	Nebivolol EP Impurity A (Desfluoro Nebivolol (Mixture of Diastereomers) )
AR-N01183-01	Nebivolol Impurity 18 HCl