2-Aminobenzaldehyde - CAS 529-23-7

Catalog:	BB027983
Product Name:	2-Aminobenzaldehyde
CAS:	529-23-7
Synonyms:	2-aminobenzaldehyde

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Computed Properties

IUPAC Name:	2-aminobenzaldehyde
Description:	2-Aminobenzaldehyde (CAS# 529-23-7) is a useful research chemical.
Molecular Weight:	121.14
Molecular Formula:	C7H7NO
Canonical SMILES:	C1=CC=C(C(=C1)C=O)N
InChI:	InChI=1S/C7H7NO/c8-7-4-2-1-3-6(7)5-9/h1-5H,8H2
InChI Key:	FXWFZIRWWNPPOV-UHFFFAOYSA-N
Boiling Point:	258.7 °C at 760 mmHg
Melting Point:	38 °C
Density:	1.171 g/cm³
Appearance:	Light yellow crystalline powder
Storage:	-20 °C
MDL:	MFCD00007709
LogP:	1.66250

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PMID	Publication Date	Title	Journal
22947183	20121030	Photocatalytic degradation of quinoline in aqueous TiO2 suspension	Journal of hazardous materials
22944335	20121001	O-Hydroxyl- or o-amino benzylamine-tacrine hybrids: multifunctional biometals chelators, antioxidants, and inhibitors of cholinesterase activity and amyloid-β aggregation	Bioorganic & medicinal chemistry
22876761	20120905	Preparation of Au/CeO2 exhibiting strong surface plasmon resonance effective for selective or chemoselective oxidation of alcohols to aldehydes or ketones in aqueous suspensions under irradiation by green light	Journal of the American Chemical Society
22371097	20120814	Synthesis and structure-activity relationships of o-sulfonamido-arylhydrazides as inhibitors of LL-diaminopimelate aminotransferase (LL-DAP-AT)	Organic & biomolecular chemistry
22341861	20120415	Colorimetric sensing of clenbuterol using gold nanoparticles in the presence of melamine	Biosensors & bioelectronics

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	103
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	121.052763847
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	121.052763847
Rotatable Bond Count:	1
Topological Polar Surface Area:	43.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.6