Name: Name:(S)-tert-Butyl 1,2,3,4-tetrahydroisoquinoline-3-carboxylate
Brand: Angene
SKU: AG005TBC
Rating: 90 (10 reviews)

(S)-tert-Butyl 1,2,3,4-tetrahydroisoquinoline-3-carboxylate

CAS No.:

77497-74-6

Catalog Number:

AG005TBC

Molecular Formula:

C14H19NO2

Molecular Weight:

233.3062

Catalog Number:

AG005TBC

Chemical Name:

(S)-tert-Butyl 1,2,3,4-tetrahydroisoquinoline-3-carboxylate

CAS Number:

77497-74-6

Molecular Formula:

C14H19NO2

Molecular Weight:

233.3062

MDL Number:

MFCD04114841

IUPAC Name:

tert-butyl (3S)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate

InChI:

InChI=1S/C14H19NO2/c1-14(2,3)17-13(16)12-8-10-6-4-5-7-11(10)9-15-12/h4-7,12,15H,8-9H2,1-3H3/t12-/m0/s1

InChI Key:

KRSUDBIZXKOKGA-LBPRGKRZSA-N

SMILES:

O=C([C@H]1NCc2c(C1)cccc2)OC(C)(C)C

Complexity:

282

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

233.142g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

233.311g/mol

Monoisotopic Mass:

233.142g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

38.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.3