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1-Aziridinyl 3-[bis(2-chloroethyl)amino]-4-methylphenyl ketone

1-Aziridinyl 3-[bis(2-chloroethyl)amino]-4-methylphenyl ketone structure

CAS No:
21447-86-9
Formula:
C14H18Cl2N2O
Chemical Name:
1-Aziridinyl 3-[bis(2-chloroethyl)amino]-4-methylphenyl ketone
Synonyms:
AZIRIDINE, 1-(3-(BIS(2-CHLOROETHYL)AMINO-p-TOLUOYL)-;CTK8H6021;1-(3-(Bis(2-chloroethyl)amino-4-methylbenzoyl)aziridine);DTXSID40175726;Ketone, 1-aziridinyl 3-(bis(2-chloroethyl)amino)-p-tolyl;ZINC1998295;aziridin-1-yl-[3-[bis(2-chloroethyl)amino]-4-methylphenyl]methanone;1-[3-[Bis(2-chloroethyl)amino]-4-methylbenzoyl]aziridine

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1-Aziridinyl 3-[bis(2-chloroethyl)amino]-4-methylphenyl ketone Basic Attributes

Molecular Weight：

301.211

Exact Mass：

300.08

DSSTox ID：

DTXSID40175726

Characteristics

PSA：

23.3

XLogP3：

2.8

Density：

1.3011 (rough estimate)

Toxicity：

Unnamed-rat LD50: 17 mg/kg

Flammability characteristics：

Flammable; burning produces toxic nitrogen oxides and chloride fumes

Safety Information

Storage features：

Treasury is ventilated, low temperature and dry; stored separately from food materials

Toxicity

Toxicity class：

most toxic

Computed Properties

Molecular Weight:301.2
XLogP3:2.8
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:6
Exact Mass:300.0796186
Monoisotopic Mass:300.0796186
Topological Polar Surface Area:23.3
Heavy Atom Count:19
Complexity:304
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-Aziridinyl 3-[bis(2-chloroethyl)amino]-4-methylphenyl ketone

Basic Attributes
Characteristics
Safety Information
Toxicity
Computed Properties
Learn More Other Chemicals

1-Aziridinyl 3-[bis(2-chloroethyl)amino]-4-methylphenyl ketone

SDS

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