Aliskiren Impurity 2; MSTP

CAT: 1299-RM-A010229-01Size: 10 mgDry Ice: NoHazardous: No

1 / 1

CAT#:1299-RM-A010229-01Size:10 mg

Selected

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

Quick Request Actions

CAS Number

2125668-23-5

Synonyms

4- (5- (methylsulfonyl) -1H-tetrazol-1-yl) phenol

Molecular Formula

C8H8N4O3S

Molecular Weight

240.24

Product Name Synonym

4- (5- (methylsulfonyl) -1H-tetrazol-1-yl) phenol

Chemical Information

4-(5-Methanesulfonyl-(1,2,3,4)tetrazol-1-yl)-phenol

structure in first source

CAS Number	2125668-23-5
PubChem CID	134824564
IUPAC Name	4-(5-methylsulfonyltetrazol-1-yl)phenol
Molecular Formula	C8H8N4O3S
Molecular Weight	240.24
XLogP	0.4
Topological Polar Surface Area	106
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	2
Heavy Atom Count	16
Formal Charge	0
Complexity	334

SMILES

CS(=O)(=O)C1=NN=NN1C2=CC=C(C=C2)O

InChI

InChI=1S/C8H8N4O3S/c1-16(14,15)8-9-10-11-12(8)6-2-4-7(13)5-3-6/h2-5,13H,1H3

InChIKey

DWSYCUKCNSVBRA-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2125668-23-5

CID: 134824564

Formula: C8H8N4O3S

MW: 240.24

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	240.24
XLogP3	0.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	2
Exact Mass	240.03171130
Monoisotopic Mass	240.03171130
Topological Polar Surface Area	106 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	334
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
RM-A010227-01	Aliskiren Impurity 1
RM-A010228-01	Aliskiren-D6
RM-A010235-01	Aliskiren Intermediate 1
RM-G271002-01	Gc376 Impurity 2; Nirmatrelvir Impurity
RM-S060226-01	Sofosbuvir Impurity 2; Sofosbuvir Impurity V
RM-V192041-01	Valsartan Impurity 41; Sacubitril Impurity 2
RM-V192107-01	Valsartan Impurity 107; Amlodipine Impurity 2
RM-K200339-01	Ketoconazole Impurity 39; Itraconazole Impurity 2
RM-I231002-01	Ivacaftor Impurity 2
RM-L011802-01	Larotrectinib Impurity 2

Catalog	Name
TRC-A536040-75MG	(2R)-Aliskiren (Aliskiren Impurity)
AR-A01650-01	Desmethoxy Aliskiren Impurity
AR-A05924-01	Hydroxy Aliskiren Impurity
AR-A01654-01	Aliskiren Impurity 1
AR-A01645-01	Aliskiren Amino Lactone Impurity
AR-A01646-01	Aliskiren Acid Impurity Sodium Salt
AR-A01653-01	Aliskiren Michael Adduct-2 Impurity
AR-A01648-01	Aliskiren Hemifumarate (SSSR isomer) Impurity
AR-A01647-01	Aliskiren Hemifumarate (RRRS isomer) Impurity
AR-A01655-01	Aliskiren Hemifumarate (RSSS isomer) Impurity