AG003PXE

1200-88-0 | (1R,2R,3R,4S)-rel-Bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid

AG003PXE

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CAS Number	1200-88-0
Catalog Number	AG003PXE(AGN-PC-0PE81V)
Chemical Name	(1R,2R,3R,4S)-rel-Bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid
IUPAC Name	(1R,2R,3R,4S)-bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid
InChI	InChI=1S/C9H10O4/c10-8(11)6-4-1-2-5(3-4)7(6)9(12)13/h1-2,4-7H,3H2,(H,10,11)(H,12,13)/t4-,5+,6-,7-/m1/s1
InChI Key	NIDNOXCRFUCAKQ-XZBKPIIZSA-N
MDL Number	MFCD00270325
Molecular Formula	C9H10O4
Molecular Weight	182.1733
SMILES	O=C(O)[C@H]1[C@H](C(=O)O)[C@@]2([H])C[C@@]1(C=C2)[H]
UNII	464GIL849I
Synonyms	1200-88-0, 5-Norbornene-2-endo,3-exo-dicarboxylic acid, UNII-464GIL849I, 464GIL849I, (1R,2R,3R,4S)-rel-Bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid, endo-Bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid, PubChem21617, SCHEMBL1462188, ZINC8575764, AKOS015894364, FCH1122248, 2-Norbornene-5,6-trans-dicarboxylic acid, AJ-89223, trans-5-Norbornene-2,3-dicarboxylic acid, 5-Norbornene-2,3-dicarboxylic acid, trans-, 5-norbornene-2-endo-3-exo-dicarboxylic acid, 5-Norbornene-2,3-dicarboxylic acid, endo,exo-, 200N880, 5-Norbornene-2,3-dicarboxylic acid, trans-(+)-, 5-Norbornene-2-endo,3-exo-dicarboxylic acid, 97%, I04-9695, 5-Norbornene-2,3-dicarboxylic acid, (1R,2R,3R,4S)-, trans-Bicyclo(2.2.1)hept-5-ene-2,3-dicarboxylic acid, endo-exo-Bicyclo(2.2.1)hept-5-ene-2,3-dicarboxylic acid, UNII-51MWF38CQG component NIDNOXCRFUCAKQ-XZBKPIIZSA-N, UNII-59ON9SNC4T component NIDNOXCRFUCAKQ-XZBKPIIZSA-N, (+/-)-endo,exo-Bicyclo(2.2.1)hept-5-ene-2,3-dicarboxylic acid, (1R,4S)-Bicyclo[2.2.1]hepta-5-ene-2beta,3alpha-dicarboxylic acid, Bicyclo(2.2.1)hept-5-ene-2,3-dicarboxylic acid, (2-endo,3-exo)-, trans-1,4-Endomethylene-delta5-cyclohexene-2,3-dicarboxylic acid, (1R,2R,3R,4S)-BICYCLO[2.2.1]HEPT-5-ENE-2,3-DICARBOXYLIC ACID, Bicyclo(2.2.1)hept-5-ene-2,3-dicarboxylic acid, (1R,2R,3R,4S)-, Bicyclo(2.2.1)hept-5-ene-2,3-dicarboxylic acid, (1R,2R,3R,4S)-rel-, Bicyclo(2.2.1)hept-5-ene-2,3-dicarboxylic acid, (1S-(2-endo,3-exo))-, 32216-02-7, UNII-59ON9SNC4T, 59ON9SNC4T, CB10356, endo,exo-bicyclo[2,2,1]hept-5-ene-2,3-dicarboxylic acid, NDC,

Complexity	266
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	4
Defined Bond Stereocenter Count	0
Exact Mass	182.058g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	182.175g/mol
Monoisotopic Mass	182.058g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	74.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.3

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number