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88218-40-0 | 2-Furancarbonylchloride, tetrahydro-4-methyl-5-oxo-, (2S-trans)- (9CI)
CAS No: 88218-40-0 Catalog No: AG004BQK MDL No:
Product Description
Catalog Number:
AG004BQK
Chemical Name:
2-Furancarbonylchloride, tetrahydro-4-methyl-5-oxo-, (2S-trans)- (9CI)
CAS Number:
88218-40-0
Molecular Formula:
C6H7ClO3
Molecular Weight:
162.5710
IUPAC Name:
(2S,4R)-4-methyl-5-oxooxolane-2-carbonyl chloride
InChI:
InChI=1S/C6H7ClO3/c1-3-2-4(5(7)8)10-6(3)9/h3-4H,2H2,1H3/t3-,4+/m1/s1
InChI Key:
KVZDTRRRPHIKLZ-DMTCNVIQSA-N
SMILES:
ClC(=O)[C@H]1OC(=O)[C@@H](C1)C
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
162.008g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
162.569g/mol
Monoisotopic Mass:
162.008g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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