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(1R,2S,3R,4S)-3-aminobicyclo[2.2.1]hept-5-ene-2-carboxylic acid hydrochloride

(1R,2S,3R,4S)-3-aminobicyclo[2.2.1]hept-5-ene-2-carboxylic acid hydrochloride

CAS: 1242184-45-7

Formula: C8H12ClNO2

SMILES: Cl.N[C@@H]1[C@H]2C[C@H](C=C2)[C@@H]1C(O)=O

IUPAC: (1R,2S,3R,4S)-3-aminobicyclo[2.2.1]hept-5-ene-2-carboxylic acid hydrochloride

InChI: InChI=1S/C8H11NO2.ClH/c9-7-5-2-1-4(3-5)6(7)8(10)11;/h1-2,4-7H,3,9H2,(H,10,11);1H/t4-,5+,6-,7+;/m0./s1

Composition: C (50.67%), H (6.38%), Cl (18.69%), N (7.39%), O (16.87%)

Molar Mass: 189.64

Atom Count: 24

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 4
Exact Mass 189.0556563
Formal Charge 0
FSP3 0.62
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey JZBHUJIMERBHKY-DABREVLYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 40.75
Topological Polar Surface Area 63.32
Polarizability 15.82
Ring Count 2
Rotatable Bond Count 1

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Purity LeadTime CAS PacketSize UnitPrice
95% <4 Days 1242184-45-7 $80.50-$495.65$80.50$151.80$495.65
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