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2936-08-5 | Pentanoyl chloride, 2-propyl-
CAS No: 2936-08-5 Catalog No: AG002Y5B MDL No:MFCD00051446
Product Description
Catalog Number:
AG002Y5B
Chemical Name:
Pentanoyl chloride, 2-propyl-
CAS Number:
2936-08-5
Molecular Formula:
C8H15ClO
Molecular Weight:
162.6571
MDL Number:
MFCD00051446
IUPAC Name:
2-propylpentanoyl chloride
InChI:
InChI=1S/C8H15ClO/c1-3-5-7(6-4-2)8(9)10/h7H,3-6H2,1-2H3
InChI Key:
PITHYUDHKJKJNQ-UHFFFAOYSA-N
SMILES:
CCCC(C(=O)Cl)CCC
EC Number:
220-914-5
Properties
Complexity:
95.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.081g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
162.657g/mol
Monoisotopic Mass:
162.081g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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