AG000P9P

1196145-11-5 | 1,3-Pyrrolidinedicarboxylic acid, 4,4-difluoro-, 1-(1,1-dimethylethyl) ester

AG000P9P

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	1196145-11-5
Catalog Number	AG000P9P(AGN-PC-0WCKD5)
Chemical Name	1,3-Pyrrolidinedicarboxylic acid, 4,4-difluoro-, 1-(1,1-dimethylethyl) ester
IUPAC Name	4,4-difluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid
InChI	InChI=1S/C10H15F2NO4/c1-9(2,3)17-8(16)13-4-6(7(14)15)10(11,12)5-13/h6H,4-5H2,1-3H3,(H,14,15)
InChI Key	GWBQDKLQWBESMQ-UHFFFAOYSA-N
MDL Number	MFCD13189575
Molecular Formula	C10H15F2NO4
Molecular Weight	251.2272
SMILES	O=C(C1CN(C(OC(C)(C)C)=O)CC1(F)F)O
Synonyms	1196145-11-5, 1-(TERT-BUTOXYCARBONYL)-4,4-DIFLUOROPYRROLIDINE-3-CARBOXYLIC ACID, 1-[(tert-butoxy)carbonyl]-4,4-difluoropyrrolidine-3-carboxylic acid, KS-000005UC, MFCD13189575, AB68684, AS-34215, CS-0052689, 1-Boc-4,4-Difluoropyrrolidine-3-carboxylic acid, 4,4-DIFLUORO-PYRROLIDINE-1,3-DICARBOXYLIC ACID 1-TERT-BUTYL ESTER, 4,4-difluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid, C10H15F2NO4,

Complexity	338
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	251.097g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	251.23g/mol
Monoisotopic Mass	251.097g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	66.8A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number