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17055-09-3 | 4,7-Dimethoxy-1,3-benzodioxole-5-carbaldehyde
CAS No: 17055-09-3 Catalog No: AG00B00H MDL No:MFCD09261479
Product Description
Catalog Number:
AG00B00H
Chemical Name:
4,7-Dimethoxy-1,3-benzodioxole-5-carbaldehyde
CAS Number:
17055-09-3
Molecular Formula:
C10H10O5
Molecular Weight:
210.1834
MDL Number:
MFCD09261479
IUPAC Name:
4,7-dimethoxy-1,3-benzodioxole-5-carbaldehyde
InChI:
InChI=1S/C10H10O5/c1-12-7-3-6(4-11)8(13-2)10-9(7)14-5-15-10/h3-4H,5H2,1-2H3
InChI Key:
BGMQYNBMPDQOCF-UHFFFAOYSA-N
SMILES:
O=Cc1cc(OC)c2c(c1OC)OCO2
NSC Number:
752391
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.053g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.185g/mol
Monoisotopic Mass:
210.053g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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