1-{tricyclo[9.4.0.0³,?]pentadeca-1(15),3,5,7,11,13-hexaen-2-yl}methanamine

1-{tricyclo[9.4.0.0³,?]pentadeca-1(15),3,5,7,11,13-hexaen-2-yl}methanamine

CAS: 7351-49-7

Formula: C16H17N

SMILES: NCC1C2=CC=CC=C2CCC2=CC=CC=C12

IUPAC: 1-{tricyclo[9.4.0.0³,?]pentadeca-1(15),3,5,7,11,13-hexaen-2-yl}methanamine

InChI: InChI=1S/C16H17N/c17-11-16-14-7-3-1-5-12(14)9-10-13-6-2-4-8-15(13)16/h1-8,16H,9-11,17H2

Composition: C (86.05%), H (7.67%), N (6.27%)

Molar Mass: 223.319

Atom Count: 34

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	223.136099551
Formal Charge	0
FSP3	0.25
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	YJCNPACNIAQKNY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	72.13
Topological Polar Surface Area	26.02
Polarizability	27.94
Ring Count	3
Rotatable Bond Count	1

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