Loline Impurity 3

CAT: 1596-AR-L07640-02Size: 25 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-L07640-02Size:25 Units

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

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CAS Number

1315552-06-7

Molecular Formula

C7H10N4O

Molecular Weight

166.18

API Name

Loline

Chemical Information

(1R,7S,8R)-8-Azido-2-oxa-6-azatricyclo[4.2.1.03,7]nonane

CAS Number	1315552-06-7
PubChem CID	131637868
IUPAC Name	(1R,7S,8R)-8-azido-2-oxa-6-azatricyclo[4.2.1.03,7]nonane
Molecular Formula	C7H10N4O
Molecular Weight	166.18
XLogP	0.9
Topological Polar Surface Area	26.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Heavy Atom Count	12
Formal Charge	0
Complexity	262

SMILES

C1CN2C[C@@H]3[C@@H]([C@H]2C1O3)N=[N+]=[N-]

InChI

InChI=1S/C7H10N4O/c8-10-9-6-5-3-11-2-1-4(12-5)7(6)11/h4-7H,1-3H2/t4?,5-,6+,7-/m1/s1

InChIKey

DBHRKAFVWRKTKR-HDLDFLEYSA-N

Chemical Structure

2D Structure

CAS: 1315552-06-7

CID: 131637868

Formula: C7H10N4O

MW: 166.18

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	166.18
XLogP3	0.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	166.08546096
Monoisotopic Mass	166.08546096
Topological Polar Surface Area	26.8 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	262
Isotope Atom Count	0
Defined Atom Stereocenter Count	3
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
AR-L07638-01	Loline Impurity 1
AR-L07639-01	Loline Impurity 2
AR-L07636-01	Loline DiHCl
AR-L07637-01	Loline-d3 DiHCl
AR-N01599-01	Nintedanib Impurity 3 (Intedanib Impurity 3)
AR-D02360-01	Doxofylline Impurity 3 (Theophylline Impurity 4)
AR-T01784-01	Theophylline Impurity 4 (Doxofylline Impurity 3)
AR-T02326-01	Tipiracil Impurity 3 (Trifluridine Impurity 5)
AR-S10368-01	Silodosin Impurity 3 (Dimer Impurity) DiHCl
AR-T02325-01	Tipiracil Impurity 2 (Trifluridine Impurity 3)

Catalog	Name
380709	Loline
TRC-I707255-25MG	(+)-Loline Dihydrochloride
453870-01	(+) -Loline Dihydrochloride
453871-01	(+) -Loline-d3 Dihydrochloride
TRC-I707257-25MG	(+)-Loline-d3 Dihydrochloride
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)
TRC-S676665-100MG	Solifenacin EP Impurity A Nitroso Impurity