4-Maleimidophenylacetic Acid - CAS 91574-45-7

Catalog:	BB040242
Product Name:	4-Maleimidophenylacetic Acid
CAS:	91574-45-7
Synonyms:	2-[4-(2,5-dioxo-1-pyrrolyl)phenyl]acetic acid; 2-[4-(2,5-dioxopyrrol-1-yl)phenyl]acetic acid

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Computed Properties

IUPAC Name:	2-[4-(2,5-dioxopyrrol-1-yl)phenyl]acetic acid
Description:	4-Maleimidophenylacetic Acid (CAS# 91574-45-7 ) is a useful research chemical.
Molecular Weight:	231.20
Molecular Formula:	C12H9NO4
Canonical SMILES:	C1=CC(=CC=C1CC(=O)O)N2C(=O)C=CC2=O
InChI:	InChI=1S/C12H9NO4/c14-10-5-6-11(15)13(10)9-3-1-8(2-4-9)7-12(16)17/h1-6H,7H2,(H,16,17)
InChI Key:	KAZUDNXBQPEPGA-UHFFFAOYSA-N
LogP:	0.80810

Publication Number	Title	Priority Date
WO-2019081455-A1	LIGAND-MEDICINAL CONJUGATE COMPRISING A UNIQUE MOLECULAR WEIGHT POLYSARCOSIN	20171023
CN-111542344-A	Ligand-drug-conjugates comprising a single molecular weight polymyosine	20171023
EP-3700577-A1	Ligand-drug-conjugate comprising a single molecular weight polysarcosine	20171023
US-2020345863-A1	Ligand-drug-conjugate comprising a single molecular weight polysarcosine	20171023
JP-2021500412-A	Ligand-drug-complex containing single molecular weight polysarcosine	20171023

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[1427004-19-0]
DBCO-PEG4-NHS ester
[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[17746-05-3]
Undecanoyl chloride
[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[957292-12-5]
2-(3-Cyclopropyl-1H-pyrazol-1-yl)acetic acid

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	362
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	231.05315777
Formal Charge:	0
Heavy Atom Count:	17
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	231.05315777
Rotatable Bond Count:	3
Topological Polar Surface Area:	74.7 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.6