Lab Chemicals

Cas#: 111072-31-2        Compound CID:  14195569

Formula:  C₂₂H₁₆N₇NaO₁₃S₂        Molecular Weight: 673.52

IUPAC Name: sodium;4-methoxy-5-[3-(2-methoxy-4-nitro-5-sulfonatophenyl)-5-(phenylcarbamoyl)tetrazol-3-ium-2-yl]-2-nitrobenzenesulfonate

SMILES: COC1=CC(=C(C=C1N2N=C(N=[N+]2C3=CC(=C(C=C3OC)[N+](=O)[O-])S(=O)(=O)[O-])C(=O)NC4=CC=CC=C4)S(=O)(=O)[O-])[N+](=O)[O-].[Na+]

InChIKey: JACYMBNQPPWQML-UHFFFAOYSA-M

InChI: InChI=1S/C22H17N7O13S2.Na/c1-41-17-8-15(28(31)32)19(43(35,36)37)10-13(17)26-24-21(22(30)23-12-6-4-3-5-7-12)25-27(26)14-11-20(44(38,39)40)16(29(33)34)9-18(14)42-2;/h3-11H,1-2H3,(H2-,23,30,35,36,37,38,39,40);/q;+1/p-1

Cas#: 30525-89-4       

Formula:  (CH₂O)_n        Molecular Weight: 30.03

IUPAC Name: formaldehyde

SMILES: C=O

InChIKey: WSFSSNUMVMOOMR-UHFFFAOYSA-N

InChI: InChI=1S/CH2O/c1-2/h1H2

Cas#: 222310-82-9        Compound CID:  99649076

Formula:  C₅₈H₇₉F₆NO₇        Molecular Weight: 1016.24

IUPAC Name: [(3R,5R,8R,9S,10S,12S,13R,14S,17R)-17-[(2R)-5-(dioctylamino)-5-oxopentan-2-yl]-10,13-dimethyl-12-[4-(2,2,2-trifluoroacetyl)benzoyl]oxy-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] 4-(2,2,2-trifluoroacetyl)benzoate

SMILES: CCCCCCCCN(CCCCCCCC)C(=O)CCC(C)C1CCC2C1(C(CC3C2CCC4C3(CCC(C4)OC(=O)C5=CC=C(C=C5)C(=O)C(F)(F)F)C)OC(=O)C6=CC=C(C=C6)C(=O)C(F)(F)F)C

InChIKey: PNOQSKXIBWVYCX-PNZPGYLPSA-N

InChI: InChI=1S/C58H79F6NO7/c1-6-8-10-12-14-16-34-65(35-17-15-13-11-9-7-2)50(66)31-18-38(3)46-29-30-47-45-28-27-43-36-44(71-53(69)41-23-19-39(20-24-41)51(67)57(59,60)61)32-33-55(43,4)48(45)37-49(56(46,47)5)72-54(70)42-25-21-40(22-26-42)52(68)58(62,63)64/h19-26,38,43-49H,6-18,27-37H2,1-5H3/t38-,43-,44-,45+,46-,47+,48+,49+,55+,56-/m1/s1

Cas#: 120945-63-3       

Formula:  C₅₆H₃₆BF₄₈NaO₈・3H₂O        Molecular Weight: 1836.65

IUPAC Name: sodium;tetrakis[3,5-bis(1,1,1,3,3,3-hexafluoro-2-methoxypropan-2-yl)phenyl]boranuide;trihydrate

SMILES: [B-](C1=CC(=CC(=C1)C(C(F)(F)F)(C(F)(F)F)OC)C(C(F)(F)F)(C(F)(F)F)OC)(C2=CC(=CC(=C2)C(C(F)(F)F)(C(F)(F)F)OC)C(C(F)(F)F)(C(F)(F)F)OC)(C3=CC(=CC(=C3)C(C(F)(F)F)(C(F)(F)F)OC)C(C(F)(F)F)(C(F)(F)F)OC)C4=CC(=CC(=C4)C(C(F)(F)F)(C(F)(F)F)OC)C(C(F)(F)F)(C(F)(F)F)OC.O.O.O.[Na+]

InChIKey: HQYSIIBSDLWUEX-UHFFFAOYSA-N

InChI: InChI=1S/C56H36BF48O8.Na.3H2O/c1-106-33(41(58,59)60,42(61,62)63)21-9-22(34(107-2,43(64,65)66)44(67,68)69)14-29(13-21)57(30-15-23(35(108-3,45(70,71)72)46(73,74)75)10-24(16-30)36(109-4,47(76,77)78)48(79,80)81,31-17-25(37(110-5,49(82,83)84)50(85,86)87)11-26(18-31)38(111-6,51(88,89)90)52(91,92)93)32-19-27(39(112-7,53(94,95)96)54(97,98)99)12-28(20-32)40(113-8,55(100,101)102)56(103,104)105;;;;/h9-20H,1-8H3;;3*1H2/q-1;+1;;;

Cas#: 107793-72-6(DMSO)       

Formula:  C₁₈H₂₄I₃N₃O₈        Molecular Weight: 791.11

SMILES: CC(=O)N(CC(CO)O)C1=C(C(=C(C(=C1I)C(=O)NCC(CO)O)I)C(=O)NCCO)I

Cas#: 1415238-77-5(DMSO)       

Formula:  C₉H₈N₂O₂        Molecular Weight: 176.17

SMILES: O=C(N1C=CN=C1)C2=C(C)OC=C2

Cas#: 107793-72-6        Compound CID:  3743

Formula:  C₁₈H₂₄I₃N₃O₈        Molecular Weight: 791.11

IUPAC Name: 5-[acetyl(2,3-dihydroxypropyl)amino]-3-N-(2,3-dihydroxypropyl)-1-N-(2-hydroxyethyl)-2,4,6-triiodobenzene-1,3-dicarboxamide

SMILES: CC(=O)N(CC(CO)O)C1=C(C(=C(C(=C1I)C(=O)NCC(CO)O)I)C(=O)NCCO)I

InChIKey: UUMLTINZBQPNGF-UHFFFAOYSA-N

InChI: InChI=1S/C18H24I3N3O8/c1-8(28)24(5-10(30)7-27)16-14(20)11(17(31)22-2-3-25)13(19)12(15(16)21)18(32)23-4-9(29)6-26/h9-10,25-27,29-30H,2-7H2,1H3,(H,22,31)(H,23,32)

Cas#: 161848-60-8       

Formula:  C₉H₁₄BrN₂O₁₅P₃.xNa        Molecular Weight: 563.04(free acid basis)

SMILES: O[C@@H]([C@H]([C@H](N1C(NC(C(Br)=C1)=O)=O)O2)O)[C@H]2COP(O)(OP(OP(O)(O)=O)(O)=O)=O.[x Na]

Cas#: 4693-01-0        Compound CID:  78414

Formula:  C₉H₆N₂O₅        Molecular Weight: 222.15

SMILES: CN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OC1=O

Cas#: 283164-79-4       

Formula:  C₁₂H₈Cl₂NNaO₃        Molecular Weight: 308.09

SMILES: O=C1C(Cl)=C/C(C=C1Cl)=N/C2=CC=C(O[Na])C=C2.O

Cas#: 774594-96-6       

SMILES: [Phosal 50 PG]