(²H?)aniline

(²H?)aniline

CAS: 4165-61-1

Formula: C6H7N

SMILES: [2H]C1=C([2H])C([2H])=C(N)C([2H])=C1[2H]

IUPAC: (²H?)aniline

InChI: InChI=1S/C6H7N/c7-6-4-2-1-3-5-6/h1-5H,7H2/i1D,2D,3D,4D,5D

Composition: C (73.42%), H (2.05%), [2H] (10.26%), N (14.27%)

Molar Mass: 98.16

Atom Count: 14

Heavy Atom Count: 7

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	98.089232959
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	PAYRUJLWNCNPSJ-RALIUCGRSA-N
Lipinski's Rule of Five	1
Molar Refractivity	30.76
Topological Polar Surface Area	26.02
Polarizability	11.5
Ring Count	1
Rotatable Bond Count	0

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CLEARSYNTH LABS

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