Name: Name:Cyclopenta[b]pyrrole-1(2H)-carboxylic acid, hexahydro-5-hydroxy-, 1,1-dimethylethyl ester
Brand: Angene
SKU: AG001HDG
Rating: 90 (10 reviews)

Cyclopenta[b]pyrrole-1(2H)-carboxylic acid, hexahydro-5-hydroxy-, 1,1-dimethylethyl ester

CAS No.:

1419101-49-7

Catalog Number:

AG001HDG

Molecular Formula:

C12H21NO3

Molecular Weight:

227.3000

Catalog Number:

AG001HDG

Chemical Name:

Cyclopenta[b]pyrrole-1(2H)-carboxylic acid, hexahydro-5-hydroxy-, 1,1-dimethylethyl ester

CAS Number:

1419101-49-7

Molecular Formula:

C12H21NO3

Molecular Weight:

227.3000

MDL Number:

MFCD23106464

IUPAC Name:

tert-butyl 5-hydroxy-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrole-1-carboxylate

InChI:

InChI=1S/C12H21NO3/c1-12(2,3)16-11(15)13-5-4-8-6-9(14)7-10(8)13/h8-10,14H,4-7H2,1-3H3

InChI Key:

JOQARDREEYWBHS-UHFFFAOYSA-N

SMILES:

OC1CC2C(C1)N(CC2)C(=O)OC(C)(C)C

Complexity:

285

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

227.152g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

227.304g/mol

Monoisotopic Mass:

227.152g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

49.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.4