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841269-03-2 | 2H-1-Benzopyran-4-amine, 6-chloro-3,4-dihydro-2,2-dimethyl-
CAS No: 841269-03-2 Catalog No: AG004PLL MDL No:MFCD09029711
Product Description
Catalog Number:
AG004PLL
Chemical Name:
2H-1-Benzopyran-4-amine, 6-chloro-3,4-dihydro-2,2-dimethyl-
CAS Number:
841269-03-2
Molecular Formula:
C11H14ClNO
Molecular Weight:
211.6880
MDL Number:
MFCD09029711
IUPAC Name:
6-chloro-2,2-dimethyl-3,4-dihydrochromen-4-amine
InChI:
InChI=1S/C11H14ClNO/c1-11(2)6-9(13)8-5-7(12)3-4-10(8)14-11/h3-5,9H,6,13H2,1-2H3
InChI Key:
YCHLOTPQPGERAD-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)C(N)CC(O2)(C)C
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.076g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
211.689g/mol
Monoisotopic Mass:
211.076g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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