Sarizotan Impurity 1

CAT: 1596-AR-S09953-01Size: 10 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-S09953-01Size:10 Units

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CAS Number

222551-22-6

Molecular Formula

C12H10FNO

Molecular Weight

203.22

API Name

Sarizotan

Chemical Information

[5-(4-Fluorophenyl)pyridin-3-yl]methanol

CAS Number	222551-22-6
PubChem CID	15541798
IUPAC Name	[5-(4-fluorophenyl)-3-pyridinyl]methanol
Molecular Formula	C12H10FNO
Molecular Weight	203.21
XLogP	1.7
Topological Polar Surface Area	33.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	15
Formal Charge	0
Complexity	192

SMILES

C1=CC(=CC=C1C2=CN=CC(=C2)CO)F

InChI

InChI=1S/C12H10FNO/c13-12-3-1-10(2-4-12)11-5-9(8-15)6-14-7-11/h1-7,15H,8H2

InChIKey

AGTFTHJYSZRWJK-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 222551-22-6

CID: 15541798

Formula: C12H10FNO

MW: 203.21

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	203.21
XLogP3	1.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	203.074642105
Monoisotopic Mass	203.074642105
Topological Polar Surface Area	33.1 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	192
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
AR-S09955-01	Sarizotan Impurity 3
AR-S09954-01	Sarizotan Impurity 2
AR-S09956-01	Sarizotan DiHCl
AR-S09958-01	Ent-Sarizotan DiHCl
AR-S09957-01	N-Nitroso Sarizotan
AR-N01491-01	Nifedipine Impurity 1 (Benidipine Impurity 5)
AR-B01168-01	Benidipine Impurity 5 (Nifedipine Impurity 1)
AR-E10592-01	MTBE Impurity 1 and MTBE Impurity 2
AR-C01419-01	Carfilzomib Impurity 1
AR-C01358-01	Carbetocin Impurity 1

Catalog	Name
BA5004-5	Sarizotan
T70044-01	Sarizotan HCl
HY-100820A	Sarizotan (hydrochloride)
HY-100820B-01	Sarizotan (dihydrochloride)
BUP03296-01	Sarizotan 2HCl
HY-100820R	Sarizotan (Standard)
RM-G271003-01	Gc376 Impurity 3; Nirmatrelvir Impurity
RM-G271002-01	Gc376 Impurity 2; Nirmatrelvir Impurity
RM-R210208-01	Rivaroxaban Impurity I (Potential Impurity)
RM-R210210-01	Rivaroxaban Impurity Iii (Potential Impurity)