Home Other Building Blocks rac-[(2R,3S)-3-methyl-2,3-dihydro-1-benzofuran-2-yl]methanamine, cis

rac-[(2R,3S)-3-methyl-2,3-dihydro-1-benzofuran-2-yl]methanamine, cis

CAS No.:
1807938-79-9
Catalog Number:
AG01BTQV
Molecular Formula:
C10H13NO
Molecular Weight:
163.2163
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Product Description
Catalog Number:
AG01BTQV
Chemical Name:
rac-[(2R,3S)-3-methyl-2,3-dihydro-1-benzofuran-2-yl]methanamine, cis
CAS Number:
1807938-79-9
Molecular Formula:
C10H13NO
Molecular Weight:
163.2163
MDL Number:
MFCD28505864
IUPAC Name:
[(2R,3R)-3-methyl-2,3-dihydro-1-benzofuran-2-yl]methanamine
InChI:
InChI=1S/C10H13NO/c1-7-8-4-2-3-5-9(8)12-10(7)6-11/h2-5,7,10H,6,11H2,1H3/t7-,10+/m1/s1
InChI Key:
MCIKYKITSIYKKC-XCBNKYQSSA-N
SMILES:
NC[C@@H]1Oc2c([C@@H]1C)cccc2
Properties
Complexity:
160  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
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:
1.4  
Properties