4-Isopropylphenylhydrazine hydrochloride - CAS 118427-29-5
Catalog: |
BB004100 |
Product Name: |
4-Isopropylphenylhydrazine hydrochloride |
CAS: |
118427-29-5 |
Synonyms: |
(4-propan-2-ylphenyl)hydrazine;hydrochloride |
IUPAC Name: | (4-propan-2-ylphenyl)hydrazine;hydrochloride |
Description: | 4-Isopropylphenylhydrazine hydrochloride (CAS# 118427-29-5) is a compound useful in organic synthesis. |
Molecular Weight: | 186.68 |
Molecular Formula: | C9H15ClN2 |
Canonical SMILES: | CC(C)C1=CC=C(C=C1)NN.Cl |
InChI: | InChI=1S/C9H14N2.ClH/c1-7(2)8-3-5-9(11-10)6-4-8;/h3-7,11H,10H2,1-2H3;1H |
InChI Key: | LMFPPUVGWDZXMB-UHFFFAOYSA-N |
Boiling Point: | 260.1 ℃ at 760 mmHg |
Melting Point: | 217 ℃ |
Purity: | 95 % |
Appearance: | White to tan powder, crystals or flakes |
Storage: | Inert atmosphere, Room Temperature |
MDL: | MFCD00013461 |
LogP: | 3.67090 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2020003119-A1 | Compounds and methods for treatment of hedgehog pathway associated conditions | 20180625 |
AU-2019294083-A1 | Compounds and methods for treatment of hedgehog pathway associated conditions | 20180625 |
CA-3104599-A1 | Compounds and methods for treatment of hedgehog pathway associated conditions | 20180625 |
EP-3810573-A1 | Compounds and methods for treatment of hedgehog pathway associated conditions | 20180625 |
CN-113329996-A | Compounds and methods for treating hedgehog pathway related disorders | 20180625 |
Complexity: | 104 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 186.0923762 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 186.0923762 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 38 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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