 Home > Encyclopedia > 1-(2-chloroethyl)-3-(1,1-dioxothiolan-3-yl)-1-nitrosourea;3-(2-chloroethyl)-1-(1,1-dioxothiolan-3-yl)-1-nitrosourea

1-(2-chloroethyl)-3-(1,1-dioxothiolan-3-yl)-1-nitrosourea;3-(2-chloroethyl)-1-(1,1-dioxothiolan-3-yl)-1-nitrosourea

1-(2-chloroethyl)-3-(1,1-dioxothiolan-3-yl)-1-nitrosourea;3-(2-chloroethyl)-1-(1,1-dioxothiolan-3-yl)-1-nitrosourea structure

CAS No:
39441-95-7
Formula:
C14H24Cl2N6O8S2
Chemical Name:
1-(2-chloroethyl)-3-(1,1-dioxothiolan-3-yl)-1-nitrosourea;3-(2-chloroethyl)-1-(1,1-dioxothiolan-3-yl)-1-nitrosourea
Synonyms:
39441-95-7;1-(2-chloroethyl)-3-(1,1-dioxidotetrahydrothiophen-3-yl)-1-nitrosourea- 3-(2-chloroethyl)-1-(1,1-dioxidotetrahydrothiophen-3-yl)-1-nitrosourea(1:1);NSC121246;DTXSID90298171;NSC-121246;Urea, S,S-dioxide, mixt. with N'-(2-chloroethyl)-N-nitroso-N-(tetrahydro-3-thienyl)urea S,S-dioxide (MF1)

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1-(2-chloroethyl)-3-(1,1-dioxothiolan-3-yl)-1-nitrosourea;3-(2-chloroethyl)-1-(1,1-dioxothiolan-3-yl)-1-nitrosourea Basic Attributes

Molecular Weight：

539.4 g/mol

Exact Mass：

538.0474095 g/mol

NSC Number：

121246

DSSTox ID：

DTXSID90298171

Characteristics

PSA：

209 Å²

Computed Properties

Molecular Weight:539.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:6
Exact Mass:538.0474095
Monoisotopic Mass:538.0474095
Topological Polar Surface Area:209
Heavy Atom Count:32
Complexity:733
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of 1-(2-chloroethyl)-3-(1,1-dioxothiolan-3-yl)-1-nitrosourea;3-(2-chloroethyl)-1-(1,1-dioxothiolan-3-yl)-1-nitrosourea

Basic Attributes
Characteristics
Computed Properties

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