Home Other Building Blocks Isobutyl Chloroformate

Isobutyl Chloroformate

CAS No.:
543-27-1
Catalog Number:
AG00351N
Molecular Formula:
C5H9ClO2
Molecular Weight:
136.5768
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Product Description
Catalog Number:
AG00351N
Chemical Name:
Isobutyl Chloroformate
CAS Number:
543-27-1
Molecular Formula:
C5H9ClO2
Molecular Weight:
136.5768
MDL Number:
MFCD00000642
IUPAC Name:
2-methylpropyl carbonochloridate
InChI:
InChI=1S/C5H9ClO2/c1-4(2)3-8-5(6)7/h4H,3H2,1-2H3
InChI Key:
YOETUEMZNOLGDB-UHFFFAOYSA-N
SMILES:
CC(COC(=O)Cl)C
EC Number:
208-840-1
UNII:
6S785TC0OB
NSC Number:
8429
UN Number:
2742
Properties
Complexity:
80.5  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.029g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
136.575g/mol
Monoisotopic Mass:
136.029g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
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