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1-(2-chloroethyl)-1-nitroso-3-(2,3,4,5,6-pentahydroxycyclohexyl)urea

1-(2-chloroethyl)-1-nitroso-3-(2,3,4,5,6-pentahydroxycyclohexyl)urea structure

CAS No:
58484-20-1
Formula:
C9H16ClN3O7
Chemical Name:
1-(2-chloroethyl)-1-nitroso-3-(2,3,4,5,6-pentahydroxycyclohexyl)urea
Synonyms:
58484-20-1;scyllo-Inositol, 1-((((2-chloroethyl)nitrosoamino)carbonyl)amino)-1-deoxy-;scyllo-Inositol, 1-[[[(2-chloroethyl)nitrosoamino]carbonyl]amino]-1-deoxy-;NSC 275618;BRN 2896043;NSC275618;1-((((2-Chloroethyl)nitrosoamino)carbonyl)amino)-1-deoxy-scyllo-inositol;DTXSID20974032;NSC-275618;Replaced CAS registry number(s): 59092-02-3;N-(2-Chloroethyl)-N-nitroso-N'-(2,3,4,5,6-pentahydroxycyclohexyl)carbamimidic acid

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1-(2-chloroethyl)-1-nitroso-3-(2,3,4,5,6-pentahydroxycyclohexyl)urea Basic Attributes

Molecular Weight：

313.69 g/mol

Exact Mass：

313.0676776 g/mol

NSC Number：

275618

Characteristics

PSA：

163 Å²

Computed Properties

Molecular Weight:313.69
XLogP3:-2.8
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:3
Exact Mass:313.0676776
Monoisotopic Mass:313.0676776
Topological Polar Surface Area:163
Heavy Atom Count:20
Complexity:344
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: fluorene; brentag; tert butanol; 1 butene; sofosbuvir velpatasvir; barium sulfate formula

Guide of 1-(2-chloroethyl)-1-nitroso-3-(2,3,4,5,6-pentahydroxycyclohexyl)urea

Basic Attributes
Characteristics
Computed Properties

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