AG000R7W

Name: 1,3-Pyrrolidinedicarboxylic acid, 3-(trifluoromethyl)-, 1-(1,1-dimethylethyl) ester
Brand: Angene Chemical
SKU: AG000R7W

1260780-23-1 | 1,3-Pyrrolidinedicarboxylic acid, 3-(trifluoromethyl)-, 1-(1,1-dimethylethyl) ester

AG000R7W

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CAS Number	1260780-23-1
Catalog Number	AG000R7W(AGN-PC-0WG3U1)
Chemical Name	1,3-Pyrrolidinedicarboxylic acid, 3-(trifluoromethyl)-, 1-(1,1-dimethylethyl) ester
IUPAC Name	1-[(2-methylpropan-2-yl)oxycarbonyl]-3-(trifluoromethyl)pyrrolidine-3-carboxylic acid
InChI	InChI=1S/C11H16F3NO4/c1-9(2,3)19-8(18)15-5-4-10(6-15,7(16)17)11(12,13)14/h4-6H2,1-3H3,(H,16,17)
InChI Key	GNGVCLGQCJEPOE-UHFFFAOYSA-N
MDL Number	MFCD11975942
Molecular Formula	C11H16F3NO4
Molecular Weight	283.2442
SMILES	O=C(C1(C(F)(F)F)CN(C(OC(C)(C)C)=O)CC1)O
Synonyms	1260780-23-1, 3-Trifluoromethyl-pyrrolidine-1,3-dicarboxylic acid 1-tert-butyl ester, 1-(tert-Butoxycarbonyl)-3-(trifluoromethyl)pyrrolidine-3-carboxylic acid, AKOS013019630, AS-73967, SC-30070, 3-Trifluoromethyl-pyrrolidine-1,3-dicarboxylic aci, 1-[(tert-butoxy)carbonyl]-3-(trifluoromethyl)pyrrolidine-3-carboxylate, 1-[(tert-butoxy)carbonyl]-3-(trifluoromethyl)pyrrolidine-3-carboxylic acid,

Complexity	388
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	283.103142g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	283.24g/mol
Monoisotopic Mass	283.103142g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	66.8Å²
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.7

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited