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87870-32-4 | 1-Propen-1-amine, N-(2,3-dihydro-4H-1-benzopyran-4-ylidene)-, (E,Z)-
CAS No: 87870-32-4 Catalog No: AG004EDK MDL No:
Product Description
Catalog Number:
AG004EDK
Chemical Name:
1-Propen-1-amine, N-(2,3-dihydro-4H-1-benzopyran-4-ylidene)-, (E,Z)-
CAS Number:
87870-32-4
Molecular Formula:
C12H13NO
Molecular Weight:
187.2377
IUPAC Name:
N-prop-1-enyl-2,3-dihydrochromen-4-imine
InChI:
InChI=1S/C12H13NO/c1-2-8-13-11-7-9-14-12-6-4-3-5-10(11)12/h2-6,8H,7,9H2,1H3
InChI Key:
YNCIGRSDIGGPQD-UHFFFAOYSA-N
SMILES:
C/C=C/N=C\1/CCOc2c1cccc2
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.1g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
187.242g/mol
Monoisotopic Mass:
187.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
21.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.4
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