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19997-54-7 | 2-Benzofuranmethanamine, 2,3-dihydro-, hydrochloride (1:1)
CAS No: 19997-54-7 Catalog No: AG002CH5 MDL No:MFCD01659957
Product Description
Catalog Number:
AG002CH5
Chemical Name:
2-Benzofuranmethanamine, 2,3-dihydro-, hydrochloride (1:1)
CAS Number:
19997-54-7
Molecular Formula:
C9H12ClNO
Molecular Weight:
185.6507
MDL Number:
MFCD01659957
IUPAC Name:
2,3-dihydro-1-benzofuran-2-ylmethanamine;hydrochloride
InChI:
InChI=1S/C9H11NO.ClH/c10-6-8-5-7-3-1-2-4-9(7)11-8;/h1-4,8H,5-6,10H2;1H
InChI Key:
VLQHTBMTNLHCAE-UHFFFAOYSA-N
SMILES:
NCC1OCc2c1cccc2.Cl
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.061g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
185.651g/mol
Monoisotopic Mass:
185.061g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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