Isopropyl Anthranilate - CAS 18189-02-1
Catalog: |
BB013849 |
Product Name: |
Isopropyl Anthranilate |
CAS: |
18189-02-1 |
Synonyms: |
2-aminobenzoic acid propan-2-yl ester; propan-2-yl 2-aminobenzoate |
IUPAC Name: | propan-2-yl 2-aminobenzoate |
Description: | Isopropyl Anthranilate (CAS# 18189-02-1) is a useful research chemical. |
Molecular Weight: | 179.22 |
Molecular Formula: | C10H13NO2 |
Canonical SMILES: | CC(C)OC(=O)C1=CC=CC=C1N |
InChI: | InChI=1S/C10H13NO2/c1-7(2)13-10(12)8-5-3-4-6-9(8)11/h3-7H,11H2,1-2H3 |
InChI Key: | XKOZHFJYXAQZJX-UHFFFAOYSA-N |
Boiling Point: | 274 °C at 760 mmHg |
Density: | 1.099 g/cm3 |
MDL: | MFCD00060604 |
LogP: | 2.41520 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112159332-A | Process and device for continuously producing bentazone intermediate anthranilic acid | 20200923 |
WO-2020239954-A1 | Arthropod control compositions | 20190531 |
WO-2020239980-A1 | Arthropod controlling composition | 20190531 |
US-2020170906-A1 | Hair care composition for cleansing and refreshing the hair and the scalp | 20181204 |
WO-2020117729-A1 | Hair care composition for cleansing and refreshing the hair and the scalp | 20181204 |
Complexity: | 180 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 179.094628657 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 179.094628657 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 52.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.7 |
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Amines and Anilines
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