N-(2-Hydroxy-3-butenyl)phthalimide - CAS 1855-22-7
Catalog: |
BB014232 |
Product Name: |
N-(2-Hydroxy-3-butenyl)phthalimide |
CAS: |
1855-22-7 |
Synonyms: |
2-(2-hydroxybut-3-enyl)isoindole-1,3-dione |
IUPAC Name: | 2-(2-hydroxybut-3-enyl)isoindole-1,3-dione |
Description: | N-(2-Hydroxy-3-butenyl)phthalimide (CAS# 1855-22-7 ) is a useful research chemical. |
Molecular Weight: | 217.22 |
Molecular Formula: | C12H11NO3 |
Canonical SMILES: | C=CC(CN1C(=O)C2=CC=CC=C2C1=O)O |
InChI: | InChI=1S/C12H11NO3/c1-2-8(14)7-13-11(15)9-5-3-4-6-10(9)12(13)16/h2-6,8,14H,1,7H2 |
InChI Key: | OWEYCEAOEGYVFC-UHFFFAOYSA-N |
Boiling Point: | 377.3 ℃ at 760 mmHg |
Density: | 1.307 g/cm3 |
LogP: | 0.76740 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
GB-2131020-A | Bis(nitro-1-imidazolyl alkylamine) platinum complexes useful in radiotherapy or chemotherapy | 19821125 |
Complexity: | 302 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 217.07389321 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 217.07389321 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 57.6 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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