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3-aminobicyclo[1.1.1]pentane-1-carboxylic acid hydrochloride

3-aminobicyclo[1.1.1]pentane-1-carboxylic acid hydrochloride

CAS: 1172097-47-0

Formula: C6H10ClNO2

SMILES: Cl.NC12CC(C1)(C2)C(O)=O

IUPAC: 3-aminobicyclo[1.1.1]pentane-1-carboxylic acid hydrochloride

InChI: InChI=1S/C6H9NO2.ClH/c7-6-1-5(2-6,3-6)4(8)9;/h1-3,7H2,(H,8,9);1H

Composition: C (44.05%), H (6.16%), Cl (21.67%), N (8.56%), O (19.56%)

Molar Mass: 163.6

Atom Count: 20

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 163.0400063
Formal Charge 0
FSP3 0.83
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey GJEQUVVCBPCCCS-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 30.63
Topological Polar Surface Area 63.32
Polarizability 12.41
Ring Count 2
Rotatable Bond Count 1

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Purity LeadTime CAS UnitPrice
97% <10 Days 1172097-47-0 Quote Only
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Purity LeadTime CAS PacketSize UnitPrice
97% <6 Days 1172097-47-0 $171.35-$584.20$171.35$300.15$584.20
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95% <5 Days 1172097-47-0 $997.00-$1,312.00$997.00$1,312.00
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Purity LeadTime CAS PacketSize UnitPrice
97% <5 Days 1172097-47-0 $191.67-$673.37$191.67$335.43$673.37
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