2-Morpholinobenzonitrile - CAS 204078-32-0

Catalog:	BB015899
Product Name:	2-Morpholinobenzonitrile
CAS:	204078-32-0
Synonyms:	2-(4-morpholinyl)benzonitrile; 2-morpholin-4-ylbenzonitrile

Technical Data

Patents

Computed Properties

IUPAC Name:	2-morpholin-4-ylbenzonitrile
Description:	2-Morpholinobenzonitrile (CAS# 204078-32-0) is a useful research chemical.
Molecular Weight:	188.23
Molecular Formula:	C11H12N2O
Canonical SMILES:	C1COCCN1C2=CC=CC=C2C#N
InChI:	InChI=1S/C11H12N2O/c12-9-10-3-1-2-4-11(10)13-5-7-14-8-6-13/h1-4H,5-8H2
InChI Key:	KSUYFCSSOHFITQ-UHFFFAOYSA-N
Boiling Point:	357.4 °C at 760 mmHg
Density:	1.17 g/cm³
MDL:	MFCD01313390
LogP:	1.45988

Publication Number	Title	Priority Date
CN-109456704-A	Metallochemistry mechanical planarization (CMP) composition and its method	20170824
EP-3447100-A1	Metal chemical mechanical planarization (cmp) composition and methods therefore	20170824
JP-2019039004-A	Metal chemical mechanical planarization (CMP) composition and method	20170824
TW-201912739-A	Metal chemical mechanical planarization (CMP) composition and method therefor	20170824
US-10465096-B2	Metal chemical mechanical planarization (CMP) composition and methods therefore	20170824

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Complexity:	227
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	188.094963011
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	188.094963011
Rotatable Bond Count:	1
Topological Polar Surface Area:	36.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.4