Name: Name:tert-butyl 2-amino-6,6-dimethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Brand: Angene
SKU: AG01AFU8
Rating: 90 (10 reviews)

tert-butyl 2-amino-6,6-dimethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

CAS No.:

1453117-17-3

Catalog Number:

AG01AFU8

Molecular Formula:

C15H23NO2S

Molecular Weight:

281.4136

Catalog Number:

AG01AFU8

Chemical Name:

tert-butyl 2-amino-6,6-dimethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

CAS Number:

1453117-17-3

Molecular Formula:

C15H23NO2S

Molecular Weight:

281.4136

MDL Number:

MFCD25239038

IUPAC Name:

tert-butyl 2-amino-6,6-dimethyl-5,7-dihydro-4H-1-benzothiophene-3-carboxylate

InChI:

InChI=1S/C15H23NO2S/c1-14(2,3)18-13(17)11-9-6-7-15(4,5)8-10(9)19-12(11)16/h6-8,16H2,1-5H3

InChI Key:

UHGIJBKLNXBFLV-UHFFFAOYSA-N

SMILES:

O=C(c1c(N)sc2c1CCC(C2)(C)C)OC(C)(C)C

Complexity:

362

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

281.145g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

281.414g/mol

Monoisotopic Mass:

281.145g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

80.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.7