Home Other Building Blocks (3,4-dihydro-1H-2-benzopyran-5-yl)methanamine

(3,4-dihydro-1H-2-benzopyran-5-yl)methanamine

CAS No.:
1511919-87-1
Catalog Number:
AG01BRLM
Molecular Formula:
C10H13NO
Molecular Weight:
163.2163
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Product Description
Catalog Number:
AG01BRLM
Chemical Name:
(3,4-dihydro-1H-2-benzopyran-5-yl)methanamine
CAS Number:
1511919-87-1
Molecular Formula:
C10H13NO
Molecular Weight:
163.2163
MDL Number:
MFCD26670281
IUPAC Name:
3,4-dihydro-1H-isochromen-5-ylmethanamine
InChI:
InChI=1S/C10H13NO/c11-6-8-2-1-3-9-7-12-5-4-10(8)9/h1-3H,4-7,11H2
InChI Key:
WURFAYKQZFHJTM-UHFFFAOYSA-N
SMILES:
NCc1cccc2c1CCOC2
Properties
Complexity:
149  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.1g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
163.22g/mol
Monoisotopic Mass:
163.1g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties