AG00HED6

118072-93-8 | Phosphonic acid, [1-hydroxy-2-(1H-imidazol-1-yl)ethylidene]bis-

AG00HED6

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CAS Number	118072-93-8
Catalog Number	AG00HED6(AGN-PC-04XYS4)
Chemical Name	Phosphonic acid, [1-hydroxy-2-(1H-imidazol-1-yl)ethylidene]bis-
IUPAC Name	(1-hydroxy-2-imidazol-1-yl-1-phosphonoethyl)phosphonic acid
InChI	InChI=1S/C5H10N2O7P2/c8-5(15(9,10)11,16(12,13)14)3-7-2-1-6-4-7/h1-2,4,8H,3H2,(H2,9,10,11)(H2,12,13,14)
InChI Key	XRASPMIURGNCCH-UHFFFAOYSA-N
MDL Number	MFCD18426508
Molecular Formula	C5H10N2O7P2
Molecular Weight	272.0896
NSC Number	721517
SMILES	OC(CN1C=CN=C1)(P(O)(O)=O)P(O)(O)=O
UNII	70HZ18PH24
Synonyms	2-(imidazol-1-yl)-1-hydroxyethylidene-1,1-bisphosphonic acid, CGP 42'446, CGP 42446, CGP 42446A, CGP-42'446, CGP-42446, CGP42'446, CGP42446, zoledronate, zoledronic acid, zoledronic acid anhydrous, Zometa, Zoledronic acid, Zoledronate, 118072-93-8, Zometa, Reclast, Aclasta, CGP 42446, (1-Hydroxy-2-(1H-imidazol-1-yl)ethane-1,1-diyl)diphosphonic acid, (1-Hydroxy-2-imidazol-1-ylethylidene)diphosphonic acid, Zomera, ZOL, CGP-42446, Aclasta and Reclast, Orazol, UNII-70HZ18PH24, [1-hydroxy-2-(1H-imidazol-1-yl)ethane-1,1-diyl]bis(phosphonic acid), Zometa (TN), CHEMBL924, 2-(imidazol-1-yl)-1-hydroxyethane-1,1-diphosphonic acid, CHEBI:46557, Phosphonic acid, [1-hydroxy-2-(1H-imidazol-1-yl)ethylidene]bis-, [1-hydroxy-2-(1H-imidazol-1-yl)-1-phosphonoethyl]phosphonic acid, 70HZ18PH24, NCGC00159521-02, (1-hydroxy-2-imidazol-1-yl-1-phosphonoethyl)phosphonic acid, AK-81486, (1-hydroxy-2-(1H-imidazol-1-yl)ethylidene)bisphosphonic acid, Zoledronic acid [USAN:INN:BAN], Q-201946, 1-hydroxy-2-(1H-imidazol-1-yl)ethane-1,1-diyldiphosphonic acid, Phosphonic acid, (1-hydroxy-2-(1H-imidazol-1-yl)ethylidene)bis-, [1-HYDROXY-2-(1H-IMIDAZOL-1-YL)-ETHYLIDENE]BISPHOSPHONIC ACID, Bisphosphonate 3, Zometa Concentrate, Zometa (Novartis), Reclast (TN), CGP-42446A, Zoledronic acid [USAN:INN], Zoledronic acid (INN), Zoledronic Acid Anhydrous, [1-Hydroxy-2-(1H-imidazol-1-yl)ethylidene]bisphosphonic acid, BPH 91, (1-hydroxy-2-(1H-imidazol-1-yl)ethane-1,1-diyl)bis(phosphonic acid), C5H10N2O7P2, ZOL 446, PubChem14894, AC1L2ACJ, Anhydrous Zoledronic Acid, Zoledronic Acid, Anhydrous, AC1Q6RN3, DSSTox_CID_22668, DSSTox_RID_80065, Zoledronic acid, Zoledronate, BIDD:PXR0134, DSSTox_GSID_42668, SCHEMBL19054, BIDD:GT0292, Zoledronic Acid (Zoledronate), GTPL3177, JMC515594 Compound 55, PHO012, DTXSID0042668, BDBM12578, CTK8A6898, XRASPMIURGNCCH-UHFFFAOYSA-N, HMS2089O09, BCP22750, CGP-4244, EBD33252, KS-00000NZ4, ZINC3803652, Tox21_111739, ANW-57498, GP9100, MFCD00867791, NSC721517, RTA-01011, s1314, STL452893, AKOS005145739, AB07564, AC-1092, AN-5259, API0004654, CS-1829, DB00399, HS-0091, MCULE-1604726355, NSC-721517, RP06507, NCGC00159521-03, NCGC00159521-04, NCGC00159521-05, BC206233, HY-13777, SC-14082, AB0013187, LS-181815, 4CH-021386, CAS-118072-93-8, FT-0082657, FT-0601384, ST24033505, Y1607, D08689, S00092, Z-1463, 42181-EP2270008A1, 42181-EP2292617A1, 42181-EP2295426A1, 42181-EP2295427A1, 42181-EP2308855A1, 42181-EP2311808A1, 42181-EP2311829A1, AB01273947-01, AB01273947-02, AB01273947-03, AB01273947_04, 072Z938, C-17113, SR-05000001436, I06-0710, SR-05000001436-1, [1-hydroxy-(1H-imidazol-1-yl)-phosphonoethyl] phos, 1-Hydroxy-2-(1-imidazolyl)ethane-1,1-diphosphonic Acid, Z1691545083, (1-hydroxy-2-imidazol-1-yl-1-phosphono-ethyl)phosphonic acid, Aclasta (TN), Zoledronic acid hydrate, Zomera (TN), Zoledronic Acid Teva, BPH 91 Orazol, Zoledronic Acid Medac, Zoledronic Acid Mylan, Zoledronic acid trihydrate, Zoledronic Acid Actavis, UNII-Y1X5LD5UCA, Zoledronic acid monohydrate, D0VM2L, Zoledronic Acid Teva Pharma, CGP 42446A, Novartis brand of zoledronic acid, CGP 42'446, CGP-42'446, CGP42446, CID68740, C5-H10-N2-O7-P2, CGP42'446, CS-O-11771, KS-1132, Zoledronic acid, 97% - 100MG 100mg, A1352, Z0031, A11010, C088658, 2-(imidazol-1-yl)-1-hydroxyethylidene-1,1-bisphosphonic acid, Zometa, Zomera, Aclasta and Reclast, Zoledronic Acid, D000077211, (1-hydroxy-2-imidazol-1-yl-phosphonoethyl)phosphonic acid monohydrate, 165800-06-6, 904894-54-8, Phosphonic acid, P,P'-[1-hydroxy-2-(1H-imidazol-1-yl)ethylidene]bis-, Hydrogen [(1r)-2-(3-Decyl-1h-Imidazol-3-Ium-1-Yl)-1-Hydroxy-1-Phosphonoethyl]phosphonate, Phosphonic acid, (1-hydroxy-2-(1H-imidazol-1-yl)ethylidene)bis-, trihydrate, 8PH,

Complexity	327
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	271.996g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	5
Isotope Atom Count	0
Molecular Weight	272.09g/mol
Monoisotopic Mass	271.996g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	153A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-4.3

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