Darunavir Impurity 24

CAT: 1299-RM-D010124-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-D010124-01Size:10 mg

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

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CAS Number

1932353-11-1

Synonyms

(3aR,4S,6aS) -4-methoxytetrahydrofuro[3,4-b]furan-2 (3H) -one

Molecular Formula

C7H10O4

Molecular Weight

158.15

Target Alternative Name

Darunavir

Chemical Information

Darunavir impurity 11

CAS Number	1932353-11-1
PubChem CID	69490808
IUPAC Name	(3aR,4S,6aS)-4-methoxy-3a,4,6,6a-tetrahydro-3H-furo[2,3-c]furan-2-one
Molecular Formula	C7H10O4
Molecular Weight	158.15
XLogP	-0.2
Topological Polar Surface Area	44.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Heavy Atom Count	11
Formal Charge	0
Complexity	179

SMILES

CO[C@@H]1[C@@H]2CC(=O)O[C@@H]2CO1

InChI

InChI=1S/C7H10O4/c1-9-7-4-2-6(8)11-5(4)3-10-7/h4-5,7H,2-3H2,1H3/t4-,5-,7+/m1/s1

InChIKey

LQEIOPTZKCKTPQ-XAHCXIQSSA-N

Chemical Structure

2D Structure

CAS: 1932353-11-1

CID: 69490808

Formula: C7H10O4

MW: 158.15

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	158.15
XLogP3	-0.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	158.05790880
Monoisotopic Mass	158.05790880
Topological Polar Surface Area	44.8 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	179
Isotope Atom Count	0
Defined Atom Stereocenter Count	3
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-D05996-01	Darunavir Dimer Impurity
AR-D06511-01	Darunavir Impurity 24
AR-D06521-01	Darunavir Impurity 11
AR-D06508-01	Darunavir Impurity 31
AR-D06504-01	Darunavir Impurity 13
AR-D06514-01	Darunavir Impurity A Enantiomer
AR-D06522-01	Darunavir Impurity 12
AR-D06512-01	Darunavir Impurity 2
AR-D06509-01	Darunavir Impurity 34
AR-D01260-01	Darunavir Impurity 17