Methyl 4-Hydrazinobenzoate Hydrochloride - CAS 6296-89-5

Name: Methyl 4-Hydrazinobenzoate Hydrochloride
Brand: BOC Sciences
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Catalog:	BB031908
Product Name:	Methyl 4-Hydrazinobenzoate Hydrochloride
CAS:	6296-89-5
Synonyms:	4-hydrazinylbenzoic acid methyl ester;hydrochloride; methyl 4-hydrazinylbenzoate;hydrochloride

Technical Data

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Computed Properties

IUPAC Name:	methyl 4-hydrazinylbenzoate;hydrochloride
Description:	Methyl 4-Hydrazinobenzoate Hydrochloride (CAS# 6296-89-5) is a useful research chemical.
Molecular Weight:	202.64
Molecular Formula:	C8H11ClN2O2
Canonical SMILES:	COC(=O)C1=CC=C(C=C1)NN.Cl
InChI:	InChI=1S/C8H10N2O2.ClH/c1-12-8(11)6-2-4-7(10-9)5-3-6;/h2-5,10H,9H2,1H3;1H
InChI Key:	MXSGRGCOQOKOEH-UHFFFAOYSA-N
Boiling Point:	923.4 °C at 760 mmHg
Density:	1.575 g/cm³
MDL:	MFCD01325154
LogP:	2.33410

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Related Functional Groups

Carbonyl Compounds

[87-88-7]C6H2Cl2O4
Chloranilic acid
[1427004-19-0]C34H39N3O10
DBCO-PEG4-NHS ester
[17746-05-3]C11H21ClO
Undecanoyl chloride
[959574-98-2]C11H10N2O2
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[70912-52-6]C10H13NO4
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-
[253429-30-0]C12H16BrFO3
1-Bromo-2-(2,2-diethoxyethoxy)-4-fluorobenzene

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GHS Hazard Statement:	H302+H312+H332 (50%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]
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
CN-112094223-A	Ureido-tetrahydrocarbazole micromolecule organic compound and application thereof	20190618
WO-2020132269-A1	Substituted pyrazolopyrimidines and substituted purines and their use as ubiquitin-specific-processing protease 1 (usp1) inhibitors	20181220
US-2021115049-A1	Substituted pyrazolopyrimidines and substituted purines and their use as ubiquitin-specific-processing protease 1 (usp1) inhibitors	20181220
EP-3897652-A1	Substituted pyrazolopyrimidines and substituted purines and their use as ubiquitin-specific-processing protease 1 (usp1) inhibitors	20181220
KR-20210105887-A	Substituted pyrazolopyrimidines and substituted purines and their use as ubiquitin-specific-processing protease 1 (USP1) inhibitors	20181220

Complexity:	153
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	202.0509053
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	3
Isotope Atom Count:	0
Monoisotopic Mass:	202.0509053
Rotatable Bond Count:	3
Topological Polar Surface Area:	64.4 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0