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3-aminomethanesulfonylaniline

3-aminomethanesulfonylaniline

CAS: 37045-73-1

Formula: C7H10N2O2S

SMILES: NCS(=O)(=O)C1=CC=CC(N)=C1

IUPAC: 3-aminomethanesulfonylaniline

InChI: InChI=1S/C7H10N2O2S/c8-5-12(10,11)7-3-1-2-6(9)4-7/h1-4H,5,8-9H2

Composition: C (45.15%), H (5.41%), N (15.04%), O (17.18%), S (17.22%)

Molar Mass: 186.23

Atom Count: 22

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 186.046298744
Formal Charge 0
FSP3 0.14
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey PSDVMPFUTMYWPP-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 47.46
Topological Polar Surface Area 86.18
Polarizability 18.99
Ring Count 1
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 37045-73-1 $590.00$590.00
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