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Home > Aldehydes > 1354951-92-0
1354951-92-0 | 7-(methylsulfanyl)-2,3-dihydro-1,4-benzodioxine-6-carbaldehyde
CAS No: 1354951-92-0 Catalog No: AG01AKNP MDL No:MFCD20233507
Product Description
Catalog Number:
AG01AKNP
Chemical Name:
7-(methylsulfanyl)-2,3-dihydro-1,4-benzodioxine-6-carbaldehyde
CAS Number:
1354951-92-0
Molecular Formula:
C10H10O3S
Molecular Weight:
210.2496
MDL Number:
MFCD20233507
IUPAC Name:
6-methylsulfanyl-2,3-dihydro-1,4-benzodioxine-7-carbaldehyde
InChI:
InChI=1S/C10H10O3S/c1-14-10-5-9-8(4-7(10)6-11)12-2-3-13-9/h4-6H,2-3H2,1H3
InChI Key:
LOSQLDCQKAVBGB-UHFFFAOYSA-N
SMILES:
O=Cc1cc2OCCOc2cc1SC
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.035g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.247g/mol
Monoisotopic Mass:
210.035g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
60.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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