Home Sulfos rac-benzyl N-[(1R,3S)-3-[(chlorosulfonyl)methyl]cyclopentyl]carbamate

rac-benzyl N-[(1R,3S)-3-[(chlorosulfonyl)methyl]cyclopentyl]carbamate

CAS No.:
1909293-75-9
Catalog Number:
AG01C1OL
Molecular Formula:
C14H18ClNO4S
Molecular Weight:
331.8150
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Product Description
Catalog Number:
AG01C1OL
Chemical Name:
rac-benzyl N-[(1R,3S)-3-[(chlorosulfonyl)methyl]cyclopentyl]carbamate
CAS Number:
1909293-75-9
Molecular Formula:
C14H18ClNO4S
Molecular Weight:
331.8150
MDL Number:
MFCD29049170
IUPAC Name:
benzyl N-[(1S,3R)-3-(chlorosulfonylmethyl)cyclopentyl]carbamate
InChI:
InChI=1S/C14H18ClNO4S/c15-21(18,19)10-12-6-7-13(8-12)16-14(17)20-9-11-4-2-1-3-5-11/h1-5,12-13H,6-10H2,(H,16,17)/t12-,13+/m1/s1
InChI Key:
OMNJXTVZOXPPOW-OLZOCXBDSA-N
SMILES:
O=C(N[C@H]1CC[C@H](C1)CS(=O)(=O)Cl)OCc1ccccc1
Properties
Complexity:
442  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
331.065g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
331.811g/mol
Monoisotopic Mass:
331.065g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
80.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties