5-Methoxy-1,2,3,4-tetrahydroisoquinoline - CAS 103030-70-2

Catalog:	BB000993
Product Name:	5-Methoxy-1,2,3,4-tetrahydroisoquinoline
CAS:	103030-70-2
Synonyms:	5-methoxy-1,2,3,4-tetrahydroisoquinoline; 5-methoxy-1,2,3,4-tetrahydroisoquinoline

Technical Data

Patents

Computed Properties

IUPAC Name:	5-methoxy-1,2,3,4-tetrahydroisoquinoline
Description:	5-Methoxy-1,2,3,4-tetrahydroisoquinoline (CAS# 103030-70-2 ) is a useful research chemical.
Molecular Weight:	163.22
Molecular Formula:	C10H13NO
Canonical SMILES:	COC1=CC=CC2=C1CCNC2
InChI:	InChI=1S/C10H13NO/c1-12-10-4-2-3-8-7-11-6-5-9(8)10/h2-4,11H,5-7H2,1H3
InChI Key:	MCJYXDLWQYGCIQ-UHFFFAOYSA-N
LogP:	1.66970

Publication Number	Title	Priority Date
WO-2021071843-A1	Muscarinic acetylcholine m1 receptor antagonists	20191007
US-2020165231-A1	Kras g12c inhibitors and methods of using the same	20181119
AU-2017277534-A1	Anti-EGFR antibody drug conjugates	20160608
AU-2017277916-A1	Anti-CD98 antibodies and antibody drug conjugates	20160608
AU-2017279554-A1	Anti-B7-H3 antibodies and antibody drug conjugates	20160608

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Related Functional Groups

Quinoline/Isoquinoline

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[361982-79-8]
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[927800-47-3]
4-Chloro-6-fluoro-2-trichloromethyl-quinoline
[938001-63-9]
9-Chloro-1-methyl-5,6,7,8-tetrahydro-1H-pyrazolo[4,3-b]quinoline
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7-Bromo-2-methylquinoline

Complexity:	149
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	163.099714038
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	163.099714038
Rotatable Bond Count:	1
Topological Polar Surface Area:	21.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.3