Home Other Building Blocks 2-(3,4-dihydro-1H-2-benzopyran-7-yl)ethan-1-amine

2-(3,4-dihydro-1H-2-benzopyran-7-yl)ethan-1-amine

CAS No.:
1367949-05-0
Catalog Number:
AG01EI9T
Molecular Formula:
C11H15NO
Molecular Weight:
177.2429
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Product Description
Catalog Number:
AG01EI9T
Chemical Name:
2-(3,4-dihydro-1H-2-benzopyran-7-yl)ethan-1-amine
CAS Number:
1367949-05-0
Molecular Formula:
C11H15NO
Molecular Weight:
177.2429
MDL Number:
MFCD22065987
IUPAC Name:
2-(3,4-dihydro-1H-isochromen-7-yl)ethanamine
InChI:
InChI=1S/C11H15NO/c12-5-3-9-1-2-10-4-6-13-8-11(10)7-9/h1-2,7H,3-6,8,12H2
InChI Key:
SOCVBIUEYOONMO-UHFFFAOYSA-N
SMILES:
NCCc1ccc2c(c1)COCC2
Properties
Complexity:
160  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.115g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
177.247g/mol
Monoisotopic Mass:
177.115g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties