2-[(Cyclopropylcarbonyl)amino]benzoic Acid - CAS 40057-21-4
Catalog: |
BB024272 |
Product Name: |
2-[(Cyclopropylcarbonyl)amino]benzoic Acid |
CAS: |
40057-21-4 |
Synonyms: |
2-[[cyclopropyl(oxo)methyl]amino]benzoic acid; 2-(cyclopropanecarbonylamino)benzoic acid |
IUPAC Name: | 2-(cyclopropanecarbonylamino)benzoic acid |
Description: | 2-[(Cyclopropylcarbonyl)amino]benzoic Acid (CAS# 40057-21-4) is a useful research chemical. |
Molecular Weight: | 205.21 |
Molecular Formula: | C11H11NO3 |
Canonical SMILES: | C1CC1C(=O)NC2=CC=CC=C2C(=O)O |
InChI: | InChI=1S/C11H11NO3/c13-10(7-5-6-7)12-9-4-2-1-3-8(9)11(14)15/h1-4,7H,5-6H2,(H,12,13)(H,14,15) |
InChI Key: | LTDDGJHJBNMJRK-UHFFFAOYSA-N |
LogP: | 2.38280 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-105745189-B | Thermoplastic polymer composition | 20130923 |
CN-105745264-B | Thermoplastic polymer composition | 20130923 |
CN-105764883-B | Thermoplastic polymer composition | 20130923 |
CN-105764971-B | Thermoplastic polymer composition | 20130923 |
EP-2118051-A1 | New compounds, methods for their preparation and use thereof | 20070206 |
Complexity: | 273 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 205.07389321 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 205.07389321 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 66.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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