545198

Cucurbit[5]uril hydrate

contains acid of crystalization

Manufacturer: Sigma Aldrich

Select a Size

Pack Size SKU Availability Price
100 MG 545198-100-MG In Stock ₹ 5,596.53

545198 - 100 MG

₹ 5,596.53

In Stock

Quantity

1

Base Price: ₹ 5,596.53

GST (18%): ₹ 1,007.375

Total Price: ₹ 6,603.905

form

solid

Quality Level

100

optical activity

[α]20/D −24°, c = 1 in H2O

contains

acid of crystalization

solubility

aqueous acid: solublesaline: solublesugar solution: soluble

SMILES string

O.Cl.[Cl-].[K+].O=C1N2CN3C4C5N(CN6C7C8N(CN9C%10C%11N(CN%12C%13C%14N(CN1C%15C2N%16CN4C(=O)N5CN7C(=O)N8CN%10C(=O)N%11CN%13C(=O)N%14CN%15C%16=O)C%12=O)C9=O)C6=O)C3=O

InChI

1S/C30H30N20O10.2ClH.K.H2O/c51-21-31-1-32-12-14-36(22(32)52)4-40-16-18-44(26(40)56)8-48-20-19-47(29(48)59)7-43-17-15-39(25(43)55)3-35(21)13-11(31)33-2-34(12)24(54)38(14)6-42(16)28(58)46(18)10-50(20)30(60)49(19)9-45(17)27(57)41(15)5-37(13)23(33)53;;;;/h11-20H,1-10H2;2*1H;;1H2/q;;;+1;/p-1/t11-,12+,13+,14-,15-,16+,17+,18-,19-,20+;;;;

InChI key

VIWLZIOPOSWHFW-DVJLYPCZSA-M

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Description

  • Application: Host material for supramolecular chemistry.
  • Features and Benefits: Biologically inert; biocompatible
  • Other Notes: May contain ca.20% water. Contains acid of crystallization.

SAFETY INFORMATION

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Compare Similar Items

Show Difference

Img

Sigma Aldrich

545198

contains acid of crystalization...


form:
solid

Quality Level:
100

optical activity:
[α]20/D −24°, c = 1 in H2O

contains:
acid of crystalization

solubility:
aqueous acid: solublesaline: solublesugar solution: soluble

SMILES string:
O.Cl.[Cl-].[K+].O=C1N2CN3C4C5N(CN6C7C8N(CN9C%10C%11N(CN%12C%13C%14N(CN1C%15C2N%16CN4C(=O)N5CN7C(=O)N8CN%10C(=O)N%11CN%13C(=O)N%14CN%15C%16=O)C%12=O)C9=O)C6=O)C3=O

InChI:
1S/C30H30N20O10.2ClH.K.H2O/c51-21-31-1-32-12-14-36(22(32)52)4-40-16-18-44(26(40)56)8-48-20-19-47(29(48)59)7-43-17-15-39(25(43)55)3-35(21)13-11(31)33-2-34(12)24(54)38(14)6-42(16)28(58)46(18)10-50(20)30(60)49(19)9-45(17)27(57)41(15)5-37(13)23(33)53;;;;/h11-20H,1-10H2;2*1H;;1H2/q;;;+1;/p-1/t11-,12+,13+,14-,15-,16+,17+,18-,19-,20+;;;;

InChI key:
VIWLZIOPOSWHFW-DVJLYPCZSA-M

Img

Sigma Aldrich

545201

contains acid of crystalization...


form:
solid

Quality Level:
100

optical activity:
__

contains:
acid of crystalization

solubility:
__

SMILES string:
O.Cl.O=C1N2CN3C4C5N(CN6C7C8N(CN9C%10C%11N(CN%12C%13C%14N(CN%15C%16C%17N(CN%18C%19C%20N(CN1C%21C2N%22CN4C(=O)N5CN7C(=O)N8CN%10C(=O)N%11CN%13C(=O)N%14CN%16C(=O)N%17CN%19C(=O)N%20CN%21C%22=O)C%18=O)C%15=O)C%12=O)C9=O)C6=O)C3=O

InChI:
1S/C42H42N28O14.ClH.H2O/c71-29-43-1-44-16-18-48(30(44)72)4-52-20-22-56(34(52)76)8-60-24-26-64(38(60)80)12-68-28-27-67(41(68)83)11-63-25-23-59(37(63)79)7-55-21-19-51(33(55)75)3-47(29)17-15(43)45-2-46(16)32(74)50(18)6-54(20)36(78)58(22)10-62(24)40(82)66(26)14-70(28)42(84)69(27)13-65(25)39(81)61(23)9-57(21)35(77)53(19)5-49(17)31(45)73;;/h15-28H,1-14H2;1H;1H2/t15-,16+,17+,18-,19-,20+,21+,22-,23-,24+,25+,26-,27-,28+;;

InChI key:
AYRJHMOIVADVIC-AGNAEYGZSA-N

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Sigma Aldrich

545228

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form:
solid

Quality Level:
100

optical activity:
[α]20/D −61°, c = 1% in H2O

contains:
acid of crystalization

solubility:
__

SMILES string:
O.Cl.O=C1N2CN3C4C5N(CN6C7C8N(CN9C%10C%11N(CN%12C%13C%14N(CN%15C%16C%17N(CN%18C%19C%20N(CN%21C%22C%23N(CN1C%24C2N%25CN4C(=O)N5CN7C(=O)N8CN%10C(=O)N%11CN%13C(=O)N%14CN%16C(=O)N%17CN%19C(=O)N%20CN%22C(=O)N%23CN%24C%25=O)C%21=O)C%18=O)C%15=O)C%12=O)C9=O)C6=O)C3=O

InChI:
1S/C48H48N32O16.ClH.H2O/c81-33-49-1-50-18-20-54(34(50)82)4-58-22-24-62(38(58)86)8-66-26-28-70(42(66)90)12-74-30-32-78(46(74)94)15-77-31-29-73(45(77)93)11-69-27-25-65(41(69)89)7-61-23-21-57(37(61)85)3-53(33)19-17(49)51-2-52(18)36(84)56(20)6-60(22)40(88)64(24)10-68(26)44(92)72(28)14-76(30)48(96)80(32)16-79(31)47(95)75(29)13-71(27)43(91)67(25)9-63(23)39(87)59(21)5-55(19)35(51)83;;/h17-32H,1-16H2;1H;1H2/t17-,18+,19+,20-,21-,22+,23+,24-,25-,26+,27+,28-,29-,30+,31+,32-;;

InChI key:
COYIBPCTQSGIKE-IIKCYMFNSA-N

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Sigma Aldrich

545236

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Quality Level:
100

optical activity:
__

contains:
__

solubility:
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SMILES string:
[H][Si]([H])(C(C)(C)C)C(C)(C)C

InChI:
1S/C8H20Si/c1-7(2,3)9-8(4,5)6/h9H2,1-6H3

InChI key:
ZLKSBZCITVUTSN-UHFFFAOYSA-N