AG003C6A

62855-02-1 | (R)-(1,2,3,4-TETRAHYDROISOQUINOLIN-3-YL)-METHANOL

AG003C6A

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CAS Number	62855-02-1
Catalog Number	AG003C6A(AGN-PC-02A1YJ)
Chemical Name	(R)-(1,2,3,4-TETRAHYDROISOQUINOLIN-3-YL)-METHANOL
IUPAC Name	[(3R)-1,2,3,4-tetrahydroisoquinolin-3-yl]methanol
InChI	InChI=1S/C10H13NO/c12-7-10-5-8-3-1-2-4-9(8)6-11-10/h1-4,10-12H,5-7H2/t10-/m1/s1
InChI Key	ZSKDXMLMMQFHGW-SNVBAGLBSA-N
MDL Number	MFCD02684327
Molecular Formula	C10H13NO
Molecular Weight	163.2163
SMILES	OC[C@@H]1NCC2=C(C=CC=C2)C1
Synonyms	62855-02-1, (R)-(1,2,3,4-Tetrahydroisoquinolin-3-yl)methanol, (R)-1,2,3,4-Tetrahydroisoquinolylmethan-3-ol, (R)-1,2,3,4-Tetrahydroisoquinolin-3-yl-methanol, (3r)-1,2,3,4-tetrahydroisoquinolin-3-ylmethanol, (R)-(1,2,3,4-Tetrahydroisoquinolin-3-YL)-Methanol, CHEMBL61490, (R)-3-HYDROXYMETHYL-1,2,3,4-TETRAHYDROISOQUINOLINE, [(3R)-1,2,3,4-tetrahydroisoquinolin-3-yl]methanol, MFCD02684327, 3-Isoquinolinemethanol, 1,2,3,4-tetrahydro-, (R)-, AC1LF5RT, Oprea1_551380, KSC288Q9P, AC1Q77R7, SCHEMBL4738129, CTK1I8897, DTXSID40352338, ZSKDXMLMMQFHGW-SNVBAGLBSA-N, ACT01977, BDBM50077540, ZINC19802513, AKOS015856165, AC-23786, AJ-75137, AS-18456, BR-35913, CJ-16401, 1,2,3,4-Tetrahydro-4-isoquinolinemethanol, DB-025429, RT-003437, ST2408109, CS-0030582, FT-0640854, W7483, S-5684, (r)-1,2,3,4-tetrahydro-3-isoquinolinemethanol, (R)-1,2,3,4-Tetrahydroisoquinoline-3-methanol, I08-1038, J-503759, (R)-(1,2,3,4-Tetrahydro-isoquinolin-3-yl)-methanol, (3R)-1,2,3,4-Tetrahydroisoquinolin-3-ylmethanol, 98%, (R)-1-(1,2,3,4-Tetrahydro-isoquinolin-3-yl)-methanol, - -METHANOL, 4,4,4-trifluoro-butan-1-ol, C10H13NO, KST-1A2333, AR-1A4279, CID723422, CB11948, (3R)-1,2,3,4-tetrahydroisoquinolin-4-ylmethanol, AE-641/40197878, (3R)-1,2,3,4-Tetrahydroisoquinolin-3-ylmethanol, 98% - 1G 1g, 18980-05-7, 45999-84-6,

Complexity	149
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	163.1g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	163.22g/mol
Monoisotopic Mass	163.1g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	32.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P280a-P304+P340-P305+P351+P338-P405-P501a
UN Code

Certificate of Analysis

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