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Home > Other Heterocycles > 100860-80-8
100860-80-8 | 1,4-Dioxaspiro[4.5]decane-8-carbonylchloride
CAS No: 100860-80-8 Catalog No: AG000327 MDL No:MFCD18806269
Product Description
Catalog Number:
AG000327
Chemical Name:
1,4-Dioxaspiro[4.5]decane-8-carbonylchloride
CAS Number:
100860-80-8
Molecular Formula:
C9H13ClO3
Molecular Weight:
204.6507
MDL Number:
MFCD18806269
IUPAC Name:
1,4-dioxaspiro[4.5]decane-8-carbonyl chloride
InChI:
InChI=1S/C9H13ClO3/c10-8(11)7-1-3-9(4-2-7)12-5-6-13-9/h7H,1-6H2
InChI Key:
RNVLYGFZBWJGTQ-UHFFFAOYSA-N
SMILES:
ClC(=O)C1CCC2(CC1)OCCO2
Properties
Complexity:
201
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.055g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.65g/mol
Monoisotopic Mass:
204.055g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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