2-Amino-6-methylbenzoic Acid - CAS 4389-50-8
Catalog: |
BB025490 |
Product Name: |
2-Amino-6-methylbenzoic Acid |
CAS: |
4389-50-8 |
Synonyms: |
2-amino-6-methylbenzoic acid; 2-amino-6-methylbenzoic acid |
IUPAC Name: | 2-amino-6-methylbenzoic acid |
Description: | 2-Amino-6-methylbenzoic Acid (CAS# 4389-50-8) is a useful research chemical. |
Molecular Weight: | 151.16 |
Molecular Formula: | C8H9NO2 |
Canonical SMILES: | CC1=C(C(=CC=C1)N)C(=O)O |
InChI: | InChI=1S/C8H9NO2/c1-5-3-2-4-6(9)7(5)8(10)11/h2-4H,9H2,1H3,(H,10,11) |
InChI Key: | XHYVBIXKORFHFM-UHFFFAOYSA-N |
Boiling Point: | 315.1 °C at 760 mmHg |
Density: | 1.254 g/cm3 |
MDL: | MFCD00007809 |
LogP: | 1.85660 |
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-113354550-A | Novel preparation method of aminomethylbenzoic acid | 20210528 |
CN-113072441-A | Preparation method of 2-methoxy-6-methylbenzoic acid | 20210419 |
CN-112830927-A | Purine quinazolinone derivative and preparation method thereof | 20210304 |
CN-112557547-A | Method for determining in vivo behavior of aminomethylbenzoic acid lyophilized preparation | 20201218 |
CN-112595795-A | Aminomethylbenzoic acid lyophilized preparation | 20201218 |
Complexity: | 158 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 151.063328530 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 151.063328530 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 63.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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