methylaminoformyl chloride - CAS 6452-47-7

Name: methylaminoformyl chloride
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB032491
Product Name:	methylaminoformyl chloride
CAS:	6452-47-7
Synonyms:	N-methylcarbamoyl chloride; N-methylcarbamoyl chloride

Technical Data

IUPAC Name:	N-methylcarbamoyl chloride
Description:	methylaminoformyl chloride (CAS# 6452-47-7) is used as a reagent in the synthesis of acylprolinamides as a new class of peptide deformylase inhibitors with in vivo antibacterial activity. Methylcarbamoyl Chloride is also used as a reagent in the synthesis of carbamate derivatives as potential dual-binding site acetylcholinesterase inhibitors.
Molecular Weight:	93.51
Molecular Formula:	C2H4ClNO
Canonical SMILES:	CNC(=O)Cl
InChI:	InChI=1S/C2H4ClNO/c1-4-2(3)5/h1H3,(H,4,5)
InChI Key:	GRRYSIXDUIAUGY-UHFFFAOYSA-N
Boiling Point:	93 °C (dec.)
Density:	1.185 g/cm³
Appearance:	White crystal
MDL:	MFCD08703300
LogP:	0.95550

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P264, P270, P301+P312, P330, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
CN-112625000-A	Synthesis method of N-alkane-1, 2-benzisothiazolin-3-ketone	20201204
CN-212894540-U	Preparation facilities of metal organic framework can be regulated and control to basicity	20200803
CN-213172140-U	Preparation facilities of alkali function composite metal organic framework	20200803
CN-111454179-A	Device and continuous process for producing methyl isocyanate by using dimethyl sulfate	20200508
CN-212403979-U	Device for producing methyl isocyanate by dimethyl sulfate	20200508

Complexity:	44.9
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	92.9981414
Formal Charge:	0
Heavy Atom Count:	5
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	92.9981414
Rotatable Bond Count:	0
Topological Polar Surface Area:	29.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.6