Home Carboxys Methyl 1,2,3,4-tetrahydroisoquinoline-6-carboxylate

Methyl 1,2,3,4-tetrahydroisoquinoline-6-carboxylate

CAS No.:
185057-00-5
Catalog Number:
AG0074MK
Molecular Formula:
C11H13NO2
Molecular Weight:
191.2264
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Product Description
Catalog Number:
AG0074MK
Chemical Name:
Methyl 1,2,3,4-tetrahydroisoquinoline-6-carboxylate
CAS Number:
185057-00-5
Molecular Formula:
C11H13NO2
Molecular Weight:
191.2264
MDL Number:
MFCD09038210
IUPAC Name:
methyl 1,2,3,4-tetrahydroisoquinoline-6-carboxylate
InChI:
InChI=1S/C11H13NO2/c1-14-11(13)9-2-3-10-7-12-5-4-8(10)6-9/h2-3,6,12H,4-5,7H2,1H3
InChI Key:
QFGFDECCVRJKHK-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc2c(c1)CCNC2
Properties
Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.095g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
191.23g/mol
Monoisotopic Mass:
191.095g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties