1-Pyrenesulfonic acid hydrate - CAS 654055-00-2
Catalog: |
BB032721 |
Product Name: |
1-Pyrenesulfonic acid hydrate |
CAS: |
654055-00-2 |
Synonyms: |
pyrene-1-sulfonic acid;hydrate |
IUPAC Name: | pyrene-1-sulfonic acid;hydrate |
Description: | 1-Pyrenesulfonic acid hydrate (CAS# 654055-00-2 ) is a useful research chemical. |
Molecular Weight: | 282.31 (anhydrous basis) |
Molecular Formula: | C16H10O3S · xH2O |
Canonical SMILES: | C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)S(=O)(=O)O.O |
InChI: | InChI=1S/C16H10O3S.H2O/c17-20(18,19)14-9-7-12-5-4-10-2-1-3-11-6-8-13(14)16(12)15(10)11;/h1-9H,(H,17,18,19);1H2 |
InChI Key: | RRDYFCSDPUHYDA-UHFFFAOYSA-N |
Boiling Point: | 633.2 °C at 760 mmHg |
Melting Point: | 125-129 °C(lit.) |
Purity: | 95 % |
MDL: | MFCD03426999 |
LogP: | 4.84720 |
GHS Hazard Statement: | H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2021077233-A1 | Methods and compositions for producing graphene polyurethane foams | 20191024 |
WO-2019158707-A1 | A method of manufacturing a graphene/graphehe oxide layer and a graphene/graphehe oxide-coated support | 20180216 |
EP-3752672-A1 | A method of manufacturing a graphene/graphehe oxide layer and a graphene/graphehe oxide-coated support | 20180216 |
CN-112218984-A | Method for manufacturing graphene/graphene oxide layers and graphene/graphene oxide coated supports | 20180216 |
US-2021009425-A1 | A method of manufacturing a graphene/graphehe oxide layer and a graphene/graphehe oxide-coated support | 20180216 |
Complexity: | 480 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 300.04563003 |
Formal Charge: | 0 |
Heavy Atom Count: | 21 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 300.04563003 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 63.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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