Name: Name:2-(1-[(TERT-BUTOXY)CARBONYL]-1,2,3,4-TETRAHYDROQUINOLIN-2-YL)ACETIC ACID
Brand: Angene
SKU: AG01EKHZ
Rating: 90 (10 reviews)

2-(1-[(TERT-BUTOXY)CARBONYL]-1,2,3,4-TETRAHYDROQUINOLIN-2-YL)ACETIC ACID

CAS No.:

683220-35-1

Catalog Number:

AG01EKHZ

Molecular Formula:

C16H21NO4

Molecular Weight:

291.3422

Catalog Number:

AG01EKHZ

Chemical Name:

2-(1-[(TERT-BUTOXY)CARBONYL]-1,2,3,4-TETRAHYDROQUINOLIN-2-YL)ACETIC ACID

CAS Number:

683220-35-1

Molecular Formula:

C16H21NO4

Molecular Weight:

291.3422

MDL Number:

MFCD03412626

IUPAC Name:

2-[1-[(2-methylpropan-2-yl)oxycarbonyl]-3,4-dihydro-2H-quinolin-2-yl]acetic acid

InChI:

InChI=1S/C16H21NO4/c1-16(2,3)21-15(20)17-12(10-14(18)19)9-8-11-6-4-5-7-13(11)17/h4-7,12H,8-10H2,1-3H3,(H,18,19)

InChI Key:

MCCJUNNXZVNMDK-UHFFFAOYSA-N

SMILES:

OC(=O)CC1CCc2c(N1C(=O)OC(C)(C)C)cccc2

Complexity:

402

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

291.147g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

291.347g/mol

Monoisotopic Mass:

291.147g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.6