Home Other Building Blocks Carbonochloridic acid, 2-methylbutyl ester

Carbonochloridic acid, 2-methylbutyl ester

CAS No.:
20412-39-9
Catalog Number:
AG0029AR
Molecular Formula:
C6H11ClO2
Molecular Weight:
150.6033
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Product Description
Catalog Number:
AG0029AR
Chemical Name:
Carbonochloridic acid, 2-methylbutyl ester
CAS Number:
20412-39-9
Molecular Formula:
C6H11ClO2
Molecular Weight:
150.6033
MDL Number:
MFCD28127255
IUPAC Name:
2-methylbutyl carbonochloridate
InChI:
InChI=1S/C6H11ClO2/c1-3-5(2)4-9-6(7)8/h5H,3-4H2,1-2H3
InChI Key:
MQNLOOJFAVAAKD-UHFFFAOYSA-N
SMILES:
CC(CC)COC(=O)Cl
Properties
Complexity:
93.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.045g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
150.602g/mol
Monoisotopic Mass:
150.045g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties