Home Other Building Blocks 9H-FLUOREN-9-YLMETHYL N-(1H-1,2,3,4-TETRAZOL-5-YLMETHYL)CARBAMATE

9H-FLUOREN-9-YLMETHYL N-(1H-1,2,3,4-TETRAZOL-5-YLMETHYL)CARBAMATE

CAS No.:
954147-16-1
Catalog Number:
AG01DWWX
Molecular Formula:
C17H15N5O2
Molecular Weight:
321.3333
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Product Description
Catalog Number:
AG01DWWX
Chemical Name:
9H-FLUOREN-9-YLMETHYL N-(1H-1,2,3,4-TETRAZOL-5-YLMETHYL)CARBAMATE
CAS Number:
954147-16-1
Molecular Formula:
C17H15N5O2
Molecular Weight:
321.3333
MDL Number:
MFCD18328504
IUPAC Name:
9H-fluoren-9-ylmethyl N-(tetrazolidin-5-ylmethyl)carbamate
InChI:
InChI=1S/C17H19N5O2/c23-17(18-9-16-19-21-22-20-16)24-10-15-13-7-3-1-5-11(13)12-6-2-4-8-14(12)15/h1-8,15-16,19-22H,9-10H2,(H,18,23)
InChI Key:
RLMXJHLBFNKMNX-UHFFFAOYSA-N
SMILES:
O=C(NCc1nnn[nH]1)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
421  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.154g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
5  
Isotope Atom Count:
0
Molecular Weight:
325.372g/mol
Monoisotopic Mass:
325.154g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
86.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties