Name: Name:1(2H)-Pyridinecarboxylic acid, 3,4-dihydro-, 1,1-dimethylethyl ester
Brand: Angene
SKU: AG000ZKA
Rating: 90 (10 reviews)

1(2H)-Pyridinecarboxylic acid, 3,4-dihydro-, 1,1-dimethylethyl ester

CAS No.:

131667-57-7

Catalog Number:

AG000ZKA

Molecular Formula:

C10H17NO2

Molecular Weight:

183.2475

Catalog Number:

AG000ZKA

Chemical Name:

1(2H)-Pyridinecarboxylic acid, 3,4-dihydro-, 1,1-dimethylethyl ester

CAS Number:

131667-57-7

Molecular Formula:

C10H17NO2

Molecular Weight:

183.2475

MDL Number:

MFCD00798175

IUPAC Name:

tert-butyl 3,4-dihydro-2H-pyridine-1-carboxylate

InChI:

InChI=1S/C10H17NO2/c1-10(2,3)13-9(12)11-7-5-4-6-8-11/h5,7H,4,6,8H2,1-3H3

InChI Key:

VIBQTJLMJANION-UHFFFAOYSA-N

SMILES:

O=C(N1CCCC=C1)OC(C)(C)C

Complexity:

216

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

183.126g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

183.251g/mol

Monoisotopic Mass:

183.126g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

29.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9