4-Butoxybenzoic acid - CAS 1498-96-0
Catalog: |
BB010459 |
Product Name: |
4-Butoxybenzoic acid |
CAS: |
1498-96-0 |
Synonyms: |
4-butoxybenzoic acid |
IUPAC Name: | 4-butoxybenzoic acid |
Description: | 4-Butoxybenzoic acid (CAS# 1498-96-0) is a useful research chemical. |
Molecular Weight: | 194.23 |
Molecular Formula: | C11H14O3 |
Canonical SMILES: | CCCCOC1=CC=C(C=C1)C(=O)O |
InChI: | InChI=1S/C11H14O3/c1-2-3-8-14-10-6-4-9(5-7-10)11(12)13/h4-7H,2-3,8H2,1H3,(H,12,13) |
InChI Key: | LAUFPZPAKULAGB-UHFFFAOYSA-N |
Boiling Point: | 319 °C at 760 mmHg |
Melting Point: | 162 °C |
Purity: | > 98.0 % (GC) (T) |
Density: | 1.106 g/cm3 |
Appearance: | White to almost white powder to crystal |
MDL: | MFCD00002546 |
LogP: | 2.56370 |
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-113341646-A | Organic film forming material, organic film forming method, pattern forming method, and compound | 20200302 |
EP-3879341-A1 | Material for forming organic film, method for forming organic film, patterning process, and compound | 20200302 |
JP-2021139926-A | Organic film forming material, organic film forming method, pattern forming method and compound | 20200302 |
KR-20210111167-A | Material for forming organic film, method for forming organic film, patterning process and compound | 20200302 |
US-2021286266-A1 | Material for forming organic film, method for forming organic film, patterning process, and compound | 20200302 |
Complexity: | 171 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 194.094294304 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 194.094294304 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 46.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.6 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS