Phthalylglycyl chloride - CAS 6780-38-7
Catalog: |
BB033399 |
Product Name: |
Phthalylglycyl chloride |
CAS: |
6780-38-7 |
Synonyms: |
2-(1,3-dioxoisoindol-2-yl)acetyl chloride |
IUPAC Name: | 2-(1,3-dioxoisoindol-2-yl)acetyl chloride |
Description: | Phthalylglycyl chloride (CAS# 6780-38-7) is an intermediate in the synthesis of 5-Aminolevulinic Acid-3-13C Hydrochloride which is a naturally occurring amino acid; precursor of tetrapyrroles in the biosynthesis of chlorophyll and heme. Antineoplastic (photosensitizer). |
Molecular Weight: | 223.61 |
Molecular Formula: | C10H6ClNO3 |
Canonical SMILES: | C1=CC=C2C(=C1)C(=O)N(C2=O)CC(=O)Cl |
InChI: | InChI=1S/C10H6ClNO3/c11-8(13)5-12-9(14)6-3-1-2-4-7(6)10(12)15/h1-4H,5H2 |
InChI Key: | RHZBRCQIKQUQHQ-UHFFFAOYSA-N |
Boiling Point: | 343.2 °C at 760 mmHg |
Density: | 1.504 g/cm3 |
Appearance: | Slight yellow to white crystalline powder |
MDL: | MFCD00192872 |
LogP: | 0.98590 |
GHS Hazard Statement: | H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P260, P264, P270, P280, P301+P310, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P330, P363, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2021116446-A1 | Functionalized heterocyclic compounds as modulators of stimulator of interferon genes (sting) | 20191211 |
WO-2021027304-A1 | Analgesic compound, preparation method therefor, and pharmaceutical use thereof | 20190814 |
CN-112789276-A | Analgesic compounds, their preparation and their pharmaceutical use | 20190814 |
CN-110240631-A | Chiral isoindolone and cyclic hexapeptide derivatives, its preparation method and purposes | 20190625 |
WO-2020257998-A1 | A conjugate of a cytotoxic agent to a cell binding molecule with branched linkers | 20190624 |
PMID | Publication Date | Title | Journal |
15789551 | 20050101 | A structurally diverse heterocyclic library: a benzothiazepine-fused beta-lactam library derived from reaction of 2,3-dihydro-1,5-benzothiazepines and acyl chlorides: synthesis and stereochemistry | Molecular diversity |
18007494 | 20041130 | Asymmetric synthesis and antimicrobial activity of some new mono and bicyclic beta-lactams | Molecules (Basel, Switzerland) |
18007409 | 20040131 | Synthesis and antimicrobial activity of some new sugar-based monocyclic beta-lactams | Molecules (Basel, Switzerland) |
Complexity: | 305 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 223.0036207 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 223.0036207 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 54.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS