Home Halogens tert-butyl N-[5-chloro-2-(oxolane-2-carbonyl)phenyl]carbamate

tert-butyl N-[5-chloro-2-(oxolane-2-carbonyl)phenyl]carbamate

CAS No.:
1955530-98-9
Catalog Number:
AG01B25M
Molecular Formula:
C16H20ClNO4
Molecular Weight:
325.7873
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01B25M
Chemical Name:
tert-butyl N-[5-chloro-2-(oxolane-2-carbonyl)phenyl]carbamate
CAS Number:
1955530-98-9
Molecular Formula:
C16H20ClNO4
Molecular Weight:
325.7873
MDL Number:
MFCD30180411
IUPAC Name:
tert-butyl N-[5-chloro-2-(oxolane-2-carbonyl)phenyl]carbamate
InChI:
InChI=1S/C16H20ClNO4/c1-16(2,3)22-15(20)18-12-9-10(17)6-7-11(12)14(19)13-5-4-8-21-13/h6-7,9,13H,4-5,8H2,1-3H3,(H,18,20)
InChI Key:
GBNBJXZHERHRKB-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)Nc1cc(Cl)ccc1C(=O)C1CCCO1
Properties
Complexity:
421  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.108g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
325.789g/mol
Monoisotopic Mass:
325.108g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Properties