N-[2-(2,4-Dichlorophenyl)-2-hydroxyethyl]formamide - CAS 71162-52-2

Catalog:	BB067624
Product Name:	N-[2-(2,4-Dichlorophenyl)-2-hydroxyethyl]formamide
CAS:	71162-52-2
Synonyms:	N-[2-(2,4-dichlorophenyl)-2-hydroxyethyl]formamide; Formamide, N-(2-(2,4-dichlorophenyl)-2-hydroxyethyl)-; N-(2-(2,4-Dichlorophenyl)-2-hydroxyethyl)formamide; [2-(2,4-Dichlorophenyl)-2-hydroxyethyl]methanimidic acid

Technical Data

IUPAC Name:	N-[2-(2,4-dichlorophenyl)-2-hydroxyethyl]formamide
Description:	N-[2-(2,4-Dichlorophenyl)-2-hydroxyethyl]formamide is an intermediate in the synthesis of impurity of miconazole (M342500). Antifungal (topical).
Molecular Weight:	234.08
Molecular Formula:	C9H9Cl2NO2
Canonical SMILES:	C1=CC(=C(C=C1Cl)Cl)C(CNC=O)O
InChI:	InChI=1S/C9H9Cl2NO2/c10-6-1-2-7(8(11)3-6)9(14)4-12-5-13/h1-3,5,9,14H,4H2,(H,12,13)
InChI Key:	JMXNGGCYKYSXGH-UHFFFAOYSA-N
Appearance:	Colourless Oil
References:	Godefroi, E.F., et al. J. Med. Chem., 12, 784 (1969), Brugmans, et al. Arch. Dermatol., 102, 428 (1970), Heel, R.C., et al. Drugs, 19, 7 (1980),.

Complexity:	192
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	233.0010339
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	233.0010339
Rotatable Bond Count:	3
Topological Polar Surface Area:	49.3Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	1.7