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(1R,4S)-bicyclo[2.2.1]heptan-2-one

(1R,4S)-bicyclo[2.2.1]heptan-2-one

CAS: 29583-35-5

Formula: C7H10O

SMILES: O=C1C[C@H]2CC[C@@H]1C2

IUPAC: (1R,4S)-bicyclo[2.2.1]heptan-2-one

InChI: InChI=1S/C7H10O/c8-7-4-5-1-2-6(7)3-5/h5-6H,1-4H2/t5-,6+/m0/s1

Composition: C (76.33%), H (9.15%), O (14.52%)

Molar Mass: 110.156

Atom Count: 18

Heavy Atom Count: 8

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 2
Exact Mass 110.073164942
Formal Charge 0
FSP3 0.86
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey KPMKEVXVVHNIEY-NTSWFWBYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 30.97
Topological Polar Surface Area 17.07
Polarizability 12.24
Ring Count 2
Rotatable Bond Count 0

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Purity (%)
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Purity LeadTime CAS PacketSize UnitPrice
97% <2 Days 29583-35-5 $1,817.00-$3,059.00$1,817.00$3,059.00$11,362.00
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