3-(3-Pyridyl)benzaldehyde - CAS 131231-24-8

Name: 3-(3-Pyridyl)benzaldehyde
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB007271
Product Name:	3-(3-Pyridyl)benzaldehyde
CAS:	131231-24-8
Synonyms:	3-(3-pyridinyl)benzaldehyde; 3-pyridin-3-ylbenzaldehyde

Technical Data

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Computed Properties

IUPAC Name:	3-pyridin-3-ylbenzaldehyde
Description:	3-(3-Pyridyl)benzaldehyde (CAS# 131231-24-8) is a useful research chemical.
Molecular Weight:	183.21
Molecular Formula:	C12H9NO
Canonical SMILES:	C1=CC(=CC(=C1)C=O)C2=CN=CC=C2
InChI:	InChI=1S/C12H9NO/c14-9-10-3-1-4-11(7-10)12-5-2-6-13-8-12/h1-9H
InChI Key:	UJPFNRWGFPAZMO-UHFFFAOYSA-N
Boiling Point:	355.8 °C at 760 mmHg
Density:	1.147 g/cm³
MDL:	MFCD02684104
LogP:	2.56110

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]C15H22O5S.Na
Sulfophenyl nonanoate sodium salt
[1427004-19-0]C34H39N3O10
DBCO-PEG4-NHS ester
[70199-62-1]C8H10ClNO
(4-Pyridyl)acetone Hydrochloride
[35153-16-3]C16H30O2
(Z)-10-Tetradecenyl Acetate
[1141669-47-7]C10H9N3O2
2-Amino-4-(1-imidazolyl)benzoic Acid
[5000-66-8]C8H6BrClO
2-Bromo-2'-chloroacetophenone

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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

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Complexity:	193
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	183.068413911
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	183.068413911
Rotatable Bond Count:	2
Topological Polar Surface Area:	30 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.9