Cas no 161282-95-7 (31H-4,21-(Methano[1,3]benzenomethano)-26,30-metheno-25H-dibenzo[q,z][1,4,7,10,13,16]hexaoxacycloheptacosin,6,7,9,10,12,13,15,16,18,19-decahydro-32,35-dimethoxy-)

31H-4,21-(Methano[1,3]benzenomethano)-26,30-metheno-25H-dibenzo[q,z][1,4,7,10,13,16]hexaoxacycloheptacosin,6,7,9,10,12,13,15,16,18,19-decahydro-32,35-dimethoxy- structure
161282-95-7 structure
Product Name:31H-4,21-(Methano[1,3]benzenomethano)-26,30-metheno-25H-dibenzo[q,z][1,4,7,10,13,16]hexaoxacycloheptacosin,6,7,9,10,12,13,15,16,18,19-decahydro-32,35-dimethoxy-
CAS No:161282-95-7
MF:C11H12O4
MW:208.210583686829
CID:136672
PubChem ID:697594
Update Time:2025-04-19

31H-4,21-(Methano[1,3]benzenomethano)-26,30-metheno-25H-dibenzo[q,z][1,4,7,10,13,16]hexaoxacycloheptacosin,6,7,9,10,12,13,15,16,18,19-decahydro-32,35-dimethoxy- Chemical and Physical Properties

Names and Identifiers

    • 31H-4,21-(Methano[1,3]benzenomethano)-26,30-metheno-25H-dibenzo[q,z][1,4,7,10,13,16]hexaoxacycloheptacosin,6,7,9,10,12,13,15,16,18,19-decahydro-32,35-dimethoxy-
    • 31H-4,21-(Methano[1,3]benzenomethano)-26,30-metheno-25H-dibenzo[q,z][1,4,7,10,13,16]hexaoxacyc...
    • 31H-4,21-(Methano[1,3]benzenomethano)-26,30-metheno-25H-dibenzo[q,z][1,4,7,10,13,16]hexaoxacycloheptacosin,6,7,9,10,12,13,15,
    • 25,26-bis-O-(diethoxyphosphoryl)calix[4]arene
    • 25,27-bis(diethoxyphosphonoxy)-26,28-dihydroxycalix[4]arene
    • 25,27-bis-O-(diethoxyphosphoryl)calixarene
    • 25,27-dimethoxycalix[4]arene-crown-6
    • 25,27-dimethoxycalix< 4> arene-crown-6
    • O,O-BIS(DIETHOXYPHOSPHORYL)CALIX[4]ARENE
    • TIMTEC-BB SBB000471
    • RARECHEM BK HC T324
    • TRANS-2,5-DIMETHOXYCINNAMIC ACID
    • 3-(2,5-DIMETHOXYPHENYL)-2-PROPENOIC ACID
    • AKOS BBS-00007757
    • OTAVA-BB BB0109770774
    • 1,3-Dimethoxycalix[4]arenecrown-6, 99+%
    • ACon1_002358
    • 3-(2,5-Dimethoxyphenyl)acrylic acid
    • SR-01000597139-1
    • W-108789
    • MEGxp0_001746
    • CHEBI:166652
    • D1972
    • 161282-95-7
    • Z57040478
    • AMY3766
    • Cinnamic acid, 2,5-dimethoxy-, trans-
    • NCGC00169921-01
    • 2,5-Dimethoxycinnamic acid
    • 2',5'-Dimethoxycinnamic acid
    • SCHEMBL529637
    • 3-(1,4-dimethoxybenzen-2-yl)prop-2E-enoic acid
    • MFCD00004378
    • AKOS000119864
    • AS-11998
    • EN300-17801
    • 2-Propenoic acid, 3-(2,5-dimethoxyphenyl)-, (2E)-
    • HMS1648D01
    • AC-10328
    • BENZYLBUTANEDIOICACIDANHYDRIDE
    • (2E)-3-(2,5-dimethoxyphenyl)prop-2-enoic acid
    • SR-01000597139
    • BRD-K27830747-001-01-0
    • 38489-74-6
    • (2E)-3-(2,5-Dimethoxyphenyl)-2-propenoic acid
    • 10538-51-9
    • 2,5-Dimethoxycinnamicacid
    • 3(1,4-dimethoxybenzene-2-yl)prop-2E-enoic acid
    • EN300-367326
    • InChI=1/C11H12O4/c1-14-9-4-5-10(15-2)8(7-9)3-6-11(12)13/h3-7H,1-2H3,(H,12,13)/b6-3
    • (E)-3-(2,5-Dimethoxyphenyl)acrylic acid
    • CS-W015224
    • 2,5-Dimethoxycinnamic acid, predominantly trans, 99%
    • (E)-3-(2,5-dimethoxyphenyl)prop-2-enoic acid
    • 2,5-Dimethoxycinnamic acid, predominantly trans
    • 90D11933-71FC-4DE6-9A98-08A4D0359C35
    • Q63409132
    • F0722-1515
    • (2E)-3-(2,5-dimethoxyphenyl)acrylic acid
    • LS-13946
    • EINECS 234-114-9
    • Inchi： 1S/C11H12O4/c1-14-9-4-5-10(15-2)8(7-9)3-6-11(12)13/h3-7H,1-2H3,(H,12,13)/b6-3+
    • InChI Key： JPQWWJZORKTMIZ-ZZXKWVIFSA-N
    • SMILES： O(C)C1C=CC(=CC=1/C=C/C(=O)O)OC

Computed Properties

  • Exact Mass: 208.07355886g/mol
  • Monoisotopic Mass: 208.07355886g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 4
  • Complexity: 237
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.8
  • Topological Polar Surface Area: 55.8?2

Experimental Properties

  • Color/Form: Not available
  • Density: 1.0519 (rough estimate)
  • Melting Point: 147-150 °C
  • Boiling Point: 639.89°C (rough estimate)
  • Refractive Index: 1.6000 (estimate)
  • PSA: 55.76000
  • LogP: 1.80160
  • Solubility: Not available

31H-4,21-(Methano[1,3]benzenomethano)-26,30-metheno-25H-dibenzo[q,z][1,4,7,10,13,16]hexaoxacycloheptacosin,6,7,9,10,12,13,15,16,18,19-decahydro-32,35-dimethoxy- Security Information

  • Hazard Category Code： 36/37/38
  • Safety Instruction： 37/39-26
  • Hazardous Material Identification： Xi
  • Risk Phrases：R36/37/38

31H-4,21-(Methano[1,3]benzenomethano)-26,30-metheno-25H-dibenzo[q,z][1,4,7,10,13,16]hexaoxacycloheptacosin,6,7,9,10,12,13,15,16,18,19-decahydro-32,35-dimethoxy- Related Literature

161282-95-7 (31H-4,21-(Methano[1,3]benzenomethano)-26,30-metheno-25H-dibenzo[q,z][1,4,7,10,13,16]hexaoxacycloheptacosin,6,7,9,10,12,13,15,16,18,19-decahydro-32,35-dimethoxy-) Related Products

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