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6-Methyl-4-isoquinolinol

CAT: 0572-TRC-M313280-2.5GSize: 2.5 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-M313280-2.5GSize:2.5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1511622-59-5
Hazard Statement
No Data Available
Smiles
Cc1ccc2cncc(O)c2c1
Molecular Formula
C10 H9 N O
Molecular Weight
159.185
InChI
InChI=1S/C10H9NO/c1-7-2-3-8-5-11-6-10(12)9(8)4-7/h2-6,12H,1H3
Additionnal Information
IUPAC name: 6-methylisoquinolin-4-ol
Shipping Conditions
Room Temperature

Chemical Information

6-Methylisoquinolin-4-ol
CAS Number1511622-59-5
PubChem CID58495769
IUPAC Name6-methylisoquinolin-4-ol
Molecular FormulaC10H9NO
Molecular Weight159.18
XLogP2.1
Topological Polar Surface Area33.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count12
Formal Charge0
Complexity160
SMILES
CC1=CC2=C(C=NC=C2C=C1)O
InChI
InChI=1S/C10H9NO/c1-7-2-3-8-5-11-6-10(12)9(8)4-7/h2-6,12H,1H3
InChIKey
RUNAPEDCXMYTFA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 6-Methylisoquinolin-4-ol
CAS: 1511622-59-5
CID: 58495769
Formula: C10H9NO
MW: 159.18
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight159.18
XLogP32.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass159.068413911
Monoisotopic Mass159.068413911
Topological Polar Surface Area33.1 Ų
Heavy Atom Count12
Formal Charge0
Complexity160
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

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Alternative Products

CatalogName
sc-4837456-Methyl-4-isoquinolinol
4387966-Methyl-4-isoquinolinol-D3
432920-014-​Isoquinolinol
BAA53282-014- (4-Methylbenzenesulfonate) -4-isoquinolinol
427080-013,4-Dihydro-7-methoxy-6-isoquinolinol
HY-W097910S3,4-Dihydro-6-methoxy-7-isoquinolinol-d3
HY-27861S3,4-Dihydro-7-methoxy-6-isoquinolinol-d3
sc-2684087-Isoquinolinol
410835-011,2,3,4-Tetrahydro-4- (1-hydroxycyclohexyl) -2-methyl-7-isoquinolinol
290018-011,2,3,4-Tetrahydro-5-isoquinolinol acetate

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