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Norsanguinarine

CAT: 0572-TRC-N825915-10MGSize: 10 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-N825915-10MGSize:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
522-30-5
Synonyms
[1,3]Benzodioxolo[5,6-c]-1,3-dioxolo[4,5-i]phenanthridine Ring Parent; 1,3-Dioxolo[i][1,3]dioxolo[4,5]benzo[1,2-c]phenanthridine; 13-Demethylsanguinarine;Demethylsanguinarine; N-Norsanguinarine; NSC 143762
Hazard Statement
No Data Available
Smiles
Nc1ccccc1OC2CCCC2
Molecular Formula
C11 H15 N O
Molecular Weight
177.243
InChI
InChI=1S/C11H15NO/c12-10-7-3-4-8-11(10)13-9-5-1-2-6-9/h3-4,7-9H,1-2,5-6,12H2
Additionnal Information
IUPAC name: 2-cyclopentyloxyaniline
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Norsanguinarine

Norsanguinarine is a member of phenanthridines.

CAS Number522-30-5
PubChem CID97679
IUPAC Name5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.02,10.04,8.014,22.017,21]tetracosa-1(24),2,4(8),9,11,13,15,17(21),22-nonaene
Molecular FormulaC19H11NO4
Molecular Weight317.3
XLogP4.3
Topological Polar Surface Area49.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count0
Heavy Atom Count24
Formal Charge0
Complexity502
SMILES
C1OC2=C(O1)C3=CN=C4C(=C3C=C2)C=CC5=CC6=C(C=C54)OCO6
InChI
InChI=1S/C19H11NO4/c1-2-12-11-3-4-15-19(24-9-21-15)14(11)7-20-18(12)13-6-17-16(5-10(1)13)22-8-23-17/h1-7H,8-9H2
InChIKey
CNXVDVMAYXLWPD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Norsanguinarine
CAS: 522-30-5
CID: 97679
Formula: C19H11NO4
MW: 317.3
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight317.3
XLogP34.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count0
Exact Mass317.06880783
Monoisotopic Mass317.06880783
Topological Polar Surface Area49.8 Ų
Heavy Atom Count24
Formal Charge0
Complexity502
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes