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10185-46-3 | 2H-1-Benzopyran-3-methanamine, 3,4-dihydro-
CAS No: 10185-46-3 Catalog No: AG0005PV MDL No:MFCD04114627
Product Description
Catalog Number:
AG0005PV
Chemical Name:
2H-1-Benzopyran-3-methanamine, 3,4-dihydro-
CAS Number:
10185-46-3
Molecular Formula:
C10H13NO
Molecular Weight:
163.2163
MDL Number:
MFCD04114627
IUPAC Name:
3,4-dihydro-2H-chromen-3-ylmethanamine
InChI:
InChI=1S/C10H13NO/c11-6-8-5-9-3-1-2-4-10(9)12-7-8/h1-4,8H,5-7,11H2
InChI Key:
CLWNCRSSFMSHDL-UHFFFAOYSA-N
SMILES:
NCC1COc2c(C1)cccc2
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:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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