N-Chlorophthalimide - CAS 3481-09-2
Catalog: |
BB022301 |
Product Name: |
N-Chlorophthalimide |
CAS: |
3481-09-2 |
Synonyms: |
2-chloroisoindole-1,3-dione |
IUPAC Name: | 2-chloroisoindole-1,3-dione |
Description: | N-Chlorophthalimide (CAS# 3481-09-2) is a useful research chemical. |
Molecular Weight: | 181.58 |
Molecular Formula: | C8H4ClNO2 |
Canonical SMILES: | C1=CC=C2C(=C1)C(=O)N(C2=O)Cl |
InChI: | InChI=1S/C8H4ClNO2/c9-10-7(11)5-3-1-2-4-6(5)8(10)12/h1-4H |
InChI Key: | WDRFYIPWHMGQPN-UHFFFAOYSA-N |
Boiling Point: | 315.1 ℃ at 760 mmHg |
Density: | 1.56 g/cm3 |
LogP: | 1.37430 |
GHS Hazard Statement: | H315 (97.44%): 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-113185533-A | Synthetic method of key intermediate of Prifloxacin | 20210427 |
CN-112876404-A | Synthesis method of phthalimide trifluoro-methionation reagent | 20210225 |
CN-113149932-A | Preparation method of heat-sensitive dye compound N-acyl phenothiazine | 20201228 |
CN-112279802-A | Preparation method of 2-chloromethyl-3-trifluoromethylpyridine | 20201012 |
CN-112047925-A | Preparation method of N- (aryl/heteroaryl) alkyl-diamide | 20200916 |
PMID | Publication Date | Title | Journal |
19660980 | 20091015 | Structural, vibrational and DFT studies on 2-chloro-1H-isoindole-1,3(2H)-dione and 2-methyl-1H-isoindole-1,3(2H)-dione | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy |
Complexity: | 217 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 180.9930561 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 180.9930561 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 37.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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