AG003LVD

77359-11-6 | 3-((4-Nitrobenzyl)oxy)-3-oxopropanoic acid

AG003LVD

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	77359-11-6
Catalog Number	AG003LVD(AGN-PC-01UVQC)
Chemical Name	3-((4-Nitrobenzyl)oxy)-3-oxopropanoic acid
IUPAC Name	3-[(4-nitrophenyl)methoxy]-3-oxopropanoic acid
InChI	InChI=1S/C10H9NO6/c12-9(13)5-10(14)17-6-7-1-3-8(4-2-7)11(15)16/h1-4H,5-6H2,(H,12,13)
InChI Key	RIGFMUNSTCPGNP-UHFFFAOYSA-N
MDL Number	MFCD00191556
Molecular Formula	C10H9NO6
Molecular Weight	239.1816
SMILES	O=C(O)CC(OCC1=CC=C([N+]([O-])=O)C=C1)=O
Synonyms	77359-11-6, 3-((4-Nitrobenzyl)oxy)-3-oxopropanoic acid, 4-Nitrobenzyl hydrogen malonate, Mono-4-nitrobenzyl Malonate, Mono p-nitro benzyl malonate, 3-[(4-nitrophenyl)methoxy]-3-oxopropanoic acid, 2-{[(4-nitrophenyl)methyl]oxycarbonyl}acetic Acid, 3-[(4-Nitrobenzyl)oxy]-3-oxopropanoic acid, Malonic Acid Mono-4-nitrobenzyl Ester, AK-49063, 3-(4-nitrobenzyloxy)-3-oxopropanoic acid, AC1LC1DT, Malonicacidmononitrobenzylester, SCHEMBL1554845, CTK2H7176, RIGFMUNSTCPGNP-UHFFFAOYSA-, DTXSID80343841, RIGFMUNSTCPGNP-UHFFFAOYSA-N, BCP12998, KS-00000G7L, ZINC2528036, ANW-37009, MFCD00191556, AKOS015890040, Malonic acid 1-(4-nitrobenzyl) ester, AC-7770, AN-6858, DS-1204, RL04961, RP02470, RTR-024730, TRA0041634, Malonic Acid mono-4-Nitro Benzyl Ester, AJ-38209, BC206077, BR-49063, OR350266, R884, SC-57920, SY014941, AB0018390, ST2410331, TR-024730, FT-0641645, M1177, 3-[(4-Nitrobenzyl)oxy]-3-oxopropanoic acid #, M-1735, MFCD00191556 (97+%), 3-[(4-nitrophenyl)methoxy]-3-oxo-propanoic acid, I01-5096, J-510742, InChI=1/C10H9NO6/c12-9(13)5-10(14)17-6-7-1-3-8(4-2-7)11(15)16/h1-4H,5-6H2,(H,12,13), 2-isobutylaziridine, 4-Nitrobenzylhydrogenmalonate, C10H9NO6, CID592642,

Complexity	302
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	239.043g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	239.183g/mol
Monoisotopic Mass	239.043g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	109A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

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