4-aminopyrimidine-5-carboxylic acid - CAS 20737-41-1
Catalog: |
BB016242 |
Product Name: |
4-aminopyrimidine-5-carboxylic acid |
CAS: |
20737-41-1 |
Synonyms: |
4-amino-5-pyrimidinecarboxylic acid; 4-aminopyrimidine-5-carboxylic acid |
IUPAC Name: | 4-aminopyrimidine-5-carboxylic acid |
Description: | 4-aminopyrimidine-5-carboxylic acid (CAS# 20737-41-1) is a useful research chemical. |
Molecular Weight: | 139.11 |
Molecular Formula: | C5H5N3O2 |
Canonical SMILES: | C1=C(C(=NC=N1)N)C(=O)O |
InChI: | InChI=1S/C5H5N3O2/c6-4-3(5(9)10)1-7-2-8-4/h1-2H,(H,9,10)(H2,6,7,8) |
InChI Key: | ZUBDZQFROMAIPT-UHFFFAOYSA-N |
Boiling Point: | 384.9 ℃ at 760 mmHg |
Purity: | 98 % |
Density: | 1.533 g/cm3 |
MDL: | MFCD00047383 |
LogP: | 0.33820 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113200924-A | 4-amino-5-pyrimidine formamide compound and preparation method and application thereof | 20210518 |
CN-110256445-B | Method for synthesizing DNA-PK inhibitor STL127705 | 20190725 |
TW-202003639-A | Photosensitive resin composition and method for producing hard relief pattern | 20180423 |
WO-2018228275-A1 | Heterocyclic compound used as mnk inhibitor | 20170612 |
TW-201625633-A | Synthesis of COPANLISIB and its dihydrochloride | 20141107 |
Complexity: | 139 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 139.038176411 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 139.038176411 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 89.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.1 |
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