Home Other Building Blocks 3,4-dihydro-2H-1-benzopyran-6-yl(phenyl)methanamine hydrochloride

3,4-dihydro-2H-1-benzopyran-6-yl(phenyl)methanamine hydrochloride

CAS No.:
108132-34-9
Catalog Number:
AG01AGIB
Molecular Formula:
C16H18ClNO
Molecular Weight:
275.7732
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Product Description
Catalog Number:
AG01AGIB
Chemical Name:
3,4-dihydro-2H-1-benzopyran-6-yl(phenyl)methanamine hydrochloride
CAS Number:
108132-34-9
Molecular Formula:
C16H18ClNO
Molecular Weight:
275.7732
MDL Number:
MFCD01662543
IUPAC Name:
3,4-dihydro-2H-chromen-6-yl(phenyl)methanamine;hydrochloride
InChI:
InChI=1S/C16H17NO.ClH/c17-16(12-5-2-1-3-6-12)14-8-9-15-13(11-14)7-4-10-18-15;/h1-3,5-6,8-9,11,16H,4,7,10,17H2;1H
InChI Key:
XRYBMXMLPIAOIL-UHFFFAOYSA-N
SMILES:
NC(c1ccc2c(c1)CCCO2)c1ccccc1.Cl
Properties
Complexity:
262  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.108g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
275.776g/mol
Monoisotopic Mass:
275.108g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties