Home > Products > (5aS,10bR)-2-(2,4,6-Triisopropylphenyl)-5a,10b-dihydro-4H,6H-indeno[2,1-b][1,2,4]triazolo[4,3-d][1,4]oxazin-2-ium tetrafluoroborate
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Product Code
F988354
CAS
1827720-97-7

(5aS,10bR)-2-(2,4,6-Triisopropylphenyl)-5a,10b-dihydro-4H,6H-indeno[2,1-b][1,2,4]triazolo[4,3-d][1,4]oxazin-2-ium tetrafluoroborate

CAS 1827720-97-7 | Product Code F988354
Pack size Price SKU UK Europe China
50 mg £50.00 F988354-50MG Enquire Enquire In Stock (5+)
100 mg £54.00 F988354-100MG Enquire Enquire In Stock (5+)
250 mg £124.00 F988354-250MG Enquire Enquire In Stock (5+)
1 g £447.00 F988354-1G Enquire Enquire In Stock (5+)

Shipping times: UK Stock – Next Day | Germany Stock – 7-10 days | China Stock – 20-24 days (Temp. Lunar New Year delay)

1

Details

2

Chemical Properties

3

Hazards

4

Transport

5

Documentation

Product Code

F988354

CAS Number

1827720-97-7

IUPAC

(1R,9S)-4-[2,4,6-tris(propan-2-yl)phenyl]-8-oxa-2,4λ⁵,5-triazatetracyclo[7.7.0.0²,⁶.0¹¹,¹⁶]hexadeca-3,5,11,13,15-pentaen-4-ylium; [tris(λ²-fluoranidyl)-λ¹-boranetriiumyl]-λ²-fluoranide

Canonical Smiles

[F-][B+3]([F-])([F-])[F-].[H][C@]12CC3=CC=CC=C3[C@@]1([H])N1C=[N+](N=C1CO2)C1=C(C=C(C=C1C(C)C)C(C)C)C(C)C

InChI

InChI=1S/C27H34N3O.BF4/c1-16(2)20-11-22(17(3)4)26(23(12-20)18(5)6)30-15-29-25(28-30)14-31-24-13-19-9-7-8-10-21(19)27(24)29;2-1(3,4)5/h7-12,15-18,24,27H,13-14H2,1-6H3;/q+1;-1/t24-,27+;/m0./s1 AuxInfo=1/0/N:17,18,6,38,12,13,28,27,29,26,19,14,31,35,21,16,7,11,30,15,25,8,10,32,36,9,23,37,22,20,34;2,1,3,4,5/E:(1,2)(3,4,5,6)(11,12)(17,18)(22,23);(2,3,4,5)/it:im;/CRV:30+1;1+3,2-1,3-1,4-1,5-1/rA:38F-B+3F-F-F-CCCCCCCCCCCCCCN+CNCHCCCCCCCCHOCCNC/rB:s1;s2;s2;s2;;s6;s7;d8;s9;s10;s11;s11;d10;s14;s15;s16;s16;s8d15;s9;d20;s21;s22;P23;s23;d25;s26;d27;s28;s25d29;s30;s23s31;P32;s32;s34;s22s35;s20d36;s7;/rC:0,-1.54,0;;0,1.54,0;1.54,0,0;-1.54,0,0;12.9798,4.2623,0;12.3749,2.8461,0;10.8459,2.6618,0;10.241,1.2456,0;8.7121,1.0614,0;8.1072,-.3548,0;6.5782,-.5391,0;9.0312,-1.5868,0;7.7881,2.2934,0;8.393,3.7096,0;7.4689,4.9416,0;8.0739,6.3578,0;5.94,4.7573,0;9.9219,3.8938,0;11.165,.0136,0;12.7049,.037,0;13.203,-1.4202,0;14.6192,-2.0251,0;13.3872,-2.9491,0;16.0164,-1.3774,0;16.4699,.0943,0;17.9712,.4373,0;19.019,-.6913,0;18.5654,-2.163,0;17.0641,-2.506,0;16.3145,-3.8513,0;14.8034,-3.554,0;15.1465,-5.0553,0;13.5714,-4.4781,0;12.1552,-3.8731,0;11.971,-2.3442,0;10.7115,-1.4581,0;13.2989,1.6141,0;

InChI Key

InChIKey=VKKLFWUHNAKJTG-LHIMUUITSA-N

UNSPSC Code

12352100

SKU

F988354

Purity

97%

Molecular Weight

503.39

Asymmetric Atoms

2

Logp

4.20978169353

H Bond Acceptors

2

SDS Documents

Pictograms

GHS07: Harmful/Irritant

Signal Word

Warning

Hazard Statements

  • H302 – Harmful if swallowed.
  • H315 – Causes skin irritation.
  • H319 – Causes serious eye irritation.
  • H335 – May cause respiratory irritation.

Precautionary Phrases

  • P101 – If medical advice is needed, have product container or label at hand.
  • P260 – Do not breathe dust/fume/gas/mist/vapours/spray.
  • P264 – Wash hands thoroughly after handling.
  • P270 – Do not eat, drink or smoke when using this product.
  • P271 – Use only outdoors or in a well-ventilated area.
  • P280 – Wear protective gloves/protective clothing and eye/face protection.
  • P301+P310 – IF SWALLOWED: Immediately call a POISON CENTER/doctor.
  • P301+P330+P331 – IF SWALLOWED: Rinse mouth. Do NOT induce vomiting.
  • P303+P361+P353 – IF ON SKIN (or hair): Take off immediately all contaminated clothing. Rinse skin with water.
  • P304+P340 – IF INHALED: Remove person to fresh air and keep comfortable for breathing.
  • P305+P351+P338 – IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
  • P321 – Specific treatment (see Section 4 on this SDS).
  • P362+P364 – Take off contaminated clothing and wash it before reuse.
  • P403+P233 – Store in a well-ventilated place. Keep container tightly closed.
  • P405 – Store locked up.
  • P501 – Dispose of contents/container to hazardous waste disposal.

Un Number

1759

Packing Group

III

Hazard Class

8

Shipping Name

CORROSIVE SOLID, N.O.S.

Download Certificate of Analysis

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