(tert-Butoxycarbonylmethyl)triphenylphosphonium bromide - CAS 59159-39-6
Catalog: |
BB043778 |
Product Name: |
(tert-Butoxycarbonylmethyl)triphenylphosphonium bromide |
CAS: |
59159-39-6 |
Synonyms: |
(2-(Tert-Butoxy)-2-oxoethyl)triphenylphosphonium bromide; MFCD00075527; NSC 82468 |
IUPAC Name: | [2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-triphenylphosphanium;bromide |
Description: | (tert-Butoxycarbonylmethyl)triphenylphosphonium bromide (CAS# 59159-39-6 ) is a useful research chemical. |
Molecular Weight: | 457.34 |
Molecular Formula: | C24H26BrO2P |
Canonical SMILES: | CC(C)(C)OC(=O)C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-] |
InChI: | InChI=1S/C24H26O2P.BrH/c1-24(2,3)26-23(25)19-27(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22;/h4-18H,19H2,1-3H3;1H/q+1;/p-1 |
InChI Key: | ZGLFRTJDWWKIAK-UHFFFAOYSA-M |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 418 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 456.08538 |
Formal Charge: | 0 |
Heavy Atom Count: | 28 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 456.08538 |
Rotatable Bond Count: | 7 |
Topological Polar Surface Area: | 26.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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