Lenvatinib Impurity 55

CAT: 1596-AR-L06763-02Size: 25 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-L06763-02Size:25 Units

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

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CAS Number

205448-66-4

Synonyms

Methyl 4-chloro-7-methoxyquinoline-6-carboxylate

Molecular Formula

C12H10ClNO3

Molecular Weight

251.67

API Name

Lenvatinib

Chemical Information

Methyl 4-chloro-7-methoxyquinoline-6-carboxylate

CAS Number	205448-66-4
PubChem CID	22646520
IUPAC Name	methyl 4-chloro-7-methoxyquinoline-6-carboxylate
Molecular Formula	C12H10ClNO3
Molecular Weight	251.66
XLogP	2.6
Topological Polar Surface Area	48.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Heavy Atom Count	17
Formal Charge	0
Complexity	287

SMILES

COC1=CC2=NC=CC(=C2C=C1C(=O)OC)Cl

InChI

InChI=1S/C12H10ClNO3/c1-16-11-6-10-7(9(13)3-4-14-10)5-8(11)12(15)17-2/h3-6H,1-2H3

InChIKey

DDDSGYZATMCUDW-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 205448-66-4

CID: 22646520

Formula: C12H10ClNO3

MW: 251.66

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	251.66
XLogP3	2.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	251.0349209
Monoisotopic Mass	251.0349209
Topological Polar Surface Area	48.4 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	287
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