Name: Name:1-[(TERT-BUTOXY)CARBONYL]-4-(PROP-2-YN-1-YL)PIPERIDINE-4-CARBOXYLIC ACID
Brand: Angene
SKU: AG01EMN8
Rating: 90 (10 reviews)

1-[(TERT-BUTOXY)CARBONYL]-4-(PROP-2-YN-1-YL)PIPERIDINE-4-CARBOXYLIC ACID

CAS No.:

1513003-16-1

Catalog Number:

AG01EMN8

Molecular Formula:

C14H21NO4

Molecular Weight:

267.3208

Catalog Number:

AG01EMN8

Chemical Name:

1-[(TERT-BUTOXY)CARBONYL]-4-(PROP-2-YN-1-YL)PIPERIDINE-4-CARBOXYLIC ACID

CAS Number:

1513003-16-1

Molecular Formula:

C14H21NO4

Molecular Weight:

267.3208

MDL Number:

MFCD22348237

IUPAC Name:

1-[(2-methylpropan-2-yl)oxycarbonyl]-4-prop-2-ynylpiperidine-4-carboxylic acid

InChI:

InChI=1S/C14H21NO4/c1-5-6-14(11(16)17)7-9-15(10-8-14)12(18)19-13(2,3)4/h1H,6-10H2,2-4H3,(H,16,17)

InChI Key:

DQNNYUPLJIZQNL-UHFFFAOYSA-N

SMILES:

C#CCC1(CCN(CC1)C(=O)OC(C)(C)C)C(=O)O

Complexity:

405

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

267.147g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

267.325g/mol

Monoisotopic Mass:

267.147g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.5