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75200-79-2 | 2,2-Dimethylbenzo[d][1,3]dioxol-5-amine hydrochloride
CAS No: 75200-79-2 Catalog No: AG005CVW MDL No:MFCD06200886
Product Description
Catalog Number:
AG005CVW
Chemical Name:
2,2-Dimethylbenzo[d][1,3]dioxol-5-amine hydrochloride
CAS Number:
75200-79-2
Molecular Formula:
C9H12ClNO2
Molecular Weight:
201.6501
MDL Number:
MFCD06200886
IUPAC Name:
2,2-dimethyl-1,3-benzodioxol-5-amine;hydrochloride
InChI:
InChI=1S/C9H11NO2.ClH/c1-9(2)11-7-4-3-6(10)5-8(7)12-9;/h3-5H,10H2,1-2H3;1H
InChI Key:
BAJJTAFSZXKUPV-UHFFFAOYSA-N
SMILES:
Nc1ccc2c(c1)OC(O2)(C)C.Cl
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.056g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
201.65g/mol
Monoisotopic Mass:
201.056g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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