Name: Name:3,5-DIMETHYL-1H-PYRROLE-2,4-DICARBOXYLIC ACID 4-TERT-BUTYL ESTER 2-ETHYL ESTER
Brand: Angene
SKU: AG00BZR8
Rating: 90 (10 reviews)

3,5-DIMETHYL-1H-PYRROLE-2,4-DICARBOXYLIC ACID 4-TERT-BUTYL ESTER 2-ETHYL ESTER

CAS No.:

361380-77-0

Catalog Number:

AG00BZR8

Molecular Formula:

C14H21NO4

Molecular Weight:

267.3208

Catalog Number:

AG00BZR8

Chemical Name:

3,5-DIMETHYL-1H-PYRROLE-2,4-DICARBOXYLIC ACID 4-TERT-BUTYL ESTER 2-ETHYL ESTER

CAS Number:

361380-77-0

Molecular Formula:

C14H21NO4

Molecular Weight:

267.3208

MDL Number:

MFCD03093037

IUPAC Name:

4-O-tert-butyl 2-O-ethyl 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate

InChI:

InChI=1S/C14H21NO4/c1-7-18-13(17)11-8(2)10(9(3)15-11)12(16)19-14(4,5)6/h15H,7H2,1-6H3

InChI Key:

XTQZSZZJWWUQON-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1[nH]c(c(c1C)C(=O)OC(C)(C)C)C

NSC Number:

157291

Complexity:

348

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:

68.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.9