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10198-31-9 | Benzofuran, 2,3,4,5,6,7-hexahydro-2-methyl-
CAS No: 10198-31-9 Catalog No: AG00065M MDL No:
Product Description
Catalog Number:
AG00065M
Chemical Name:
Benzofuran, 2,3,4,5,6,7-hexahydro-2-methyl-
CAS Number:
10198-31-9
Molecular Formula:
C9H14O
Molecular Weight:
138.2069
IUPAC Name:
2-methyl-2,3,4,5,6,7-hexahydro-1-benzofuran
InChI:
InChI=1S/C9H14O/c1-7-6-8-4-2-3-5-9(8)10-7/h7H,2-6H2,1H3
InChI Key:
PMCGNXLCXSEVNB-UHFFFAOYSA-N
SMILES:
CC1CC2=C(O1)CCCC2
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.104g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
138.21g/mol
Monoisotopic Mass:
138.104g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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