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1392218-82-4 | 2H-1-Benzopyran-4-amine, 3,4-dihydro-6-methyl-, hydrochloride (1:1), (4S)-
CAS No: 1392218-82-4 Catalog No: AG001AIH MDL No:MFCD21603770
Product Description
Catalog Number:
AG001AIH
Chemical Name:
2H-1-Benzopyran-4-amine, 3,4-dihydro-6-methyl-, hydrochloride (1:1), (4S)-
CAS Number:
1392218-82-4
Molecular Formula:
C10H14ClNO
Molecular Weight:
199.6773
MDL Number:
MFCD21603770
IUPAC Name:
(4S)-6-methyl-3,4-dihydro-2H-chromen-4-amine;hydrochloride
InChI:
InChI=1S/C10H13NO.ClH/c1-7-2-3-10-8(6-7)9(11)4-5-12-10;/h2-3,6,9H,4-5,11H2,1H3;1H/t9-;/m0./s1
InChI Key:
XDTASUXSWBNHHX-FVGYRXGTSA-N
SMILES:
Cc1ccc2c(c1)[C@@H](N)CCO2.Cl
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
199.076g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
199.678g/mol
Monoisotopic Mass:
199.076g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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