4-(Tert-butoxycarbonylamino)-4-(4-chlorophenyl)butyl methanesulfonate

HCID 57750318
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Basic information

Standard SMILES
CC(C)(C)OC(=O)NC(CCCOS(C)(=O)=O)c1ccc(Cl)cc1
InChIKey
SKBHMDZQERZEPI-UHFFFAOYSA-N
Molecular formula
C16H24ClNO5S
Average molar mass
377.9 g/mol

Names & identifiers

Preferred name
4-(Tert-butoxycarbonylamino)-4-(4-chlorophenyl)butyl methanesulfonate
IUPAC
[4-(4-chlorophenyl)-4-[(2-methylpropan-2-yl)oxycarbonylamino]butyl] methanesulfonate

Names & synonyms

4-(tert-butoxycarbonylamino)-4-(4-chlorophenyl)butyl methanesulfonateSCHEMBL393468SKBHMDZQERZEPI-UHFFFAOYSA-N1143534-69-3DB-294876

Database identifiers

PubChem CID
57750318

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
90.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
9
Heavy atoms
24

Related reactions

3 records
New reaction record

Compound notes

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