6-Benzyloxy-2-benzoxazolinone - CAS 158822-84-5
Catalog: |
BB011466 |
Product Name: |
6-Benzyloxy-2-benzoxazolinone |
CAS: |
158822-84-5 |
Synonyms: |
6-phenylmethoxy-3H-1,3-benzoxazol-2-one |
IUPAC Name: | 6-phenylmethoxy-3H-1,3-benzoxazol-2-one |
Description: | 6-Benzyloxy-2-benzoxazolinone (CAS# 158822-84-5) is a useful research chemical. |
Molecular Weight: | 241.24 |
Molecular Formula: | C14H11NO3 |
Canonical SMILES: | C1=CC=C(C=C1)COC2=CC3=C(C=C2)NC(=O)O3 |
InChI: | InChI=1S/C14H11NO3/c16-14-15-12-7-6-11(8-13(12)18-14)17-9-10-4-2-1-3-5-10/h1-8H,9H2,(H,15,16) |
InChI Key: | JVUPJESJQYCFOB-UHFFFAOYSA-N |
Density: | 1.291 g/cm3 |
MDL: | MFCD07369766 |
LogP: | 2.70010 |
GHS Hazard Statement: | H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P280, P305+P351+P338, and P337+P313 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2020132483-A1 | Rifamycin analogs and antibody-drug conjugates thereof | 20181221 |
US-2020368361-A1 | Rifamycin analogs and antibody-drug conjugates thereof | 20181221 |
EP-3897841-A1 | Rifamycin analogs and antibody-drug conjugates thereof | 20181221 |
KR-20210107752-A | Rifamycin analogs and antibody-drug conjugates thereof | 20181221 |
US-2019367631-A1 | Anti-msr1 antibodies and methods of use thereof | 20180509 |
Complexity: | 301 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 241.07389321 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 241.07389321 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 47.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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