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1-(2-chloroethyl)-3-(1,1-dioxothian-4-yl)urea

1-(2-chloroethyl)-3-(1,1-dioxothian-4-yl)urea structure

CAS No:
33021-64-6
Formula:
C8H15ClN2O3S
Chemical Name:
1-(2-chloroethyl)-3-(1,1-dioxothian-4-yl)urea
Synonyms:
33021-64-6;1-(2-chloroethyl)-3-(1,1-dioxidotetrahydro-2h-thiopyran-4-yl)urea;NSC106629;DTXSID80295977;NSC-106629

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1-(2-chloroethyl)-3-(1,1-dioxothian-4-yl)urea Basic Attributes

Molecular Weight：

254.74 g/mol

Exact Mass：

254.0491912 g/mol

NSC Number：

106629

DSSTox ID：

DTXSID80295977

Characteristics

PSA：

83.6 Å²

Computed Properties

Molecular Weight:254.74
XLogP3:-0.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:254.0491912
Monoisotopic Mass:254.0491912
Topological Polar Surface Area:83.6
Heavy Atom Count:15
Complexity:298
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(2-chloroethyl)-3-(1,1-dioxothian-4-yl)urea

Basic Attributes
Characteristics
Computed Properties

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