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(1S,3R)-3-amino-1-methylcyclohexan-1-ol hydrochloride

(1S,3R)-3-amino-1-methylcyclohexan-1-ol hydrochloride

CAS: 100508-03-0

Formula: C7H16ClNO

SMILES: Cl.C[C@]1(O)CCC[C@@H](N)C1

IUPAC: (1S,3R)-3-amino-1-methylcyclohexan-1-ol hydrochloride

InChI: InChI=1S/C7H15NO.ClH/c1-7(9)4-2-3-6(8)5-7;/h6,9H,2-5,8H2,1H3;1H/t6-,7+;/m1./s1

Composition: C (50.75%), H (9.74%), Cl (21.40%), N (8.46%), O (9.66%)

Molar Mass: 165.66

Atom Count: 26

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 2
Exact Mass 165.0920418
Formal Charge 0
FSP3 1
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey FDAPWIUOHGULIJ-HHQFNNIRSA-N
Lipinski's Rule of Five 1
Molar Refractivity 37.2
Topological Polar Surface Area 46.25
Polarizability 15.04
Ring Count 1
Rotatable Bond Count 0

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 100508-03-0 $457.70-$9,197.70$457.70$687.70$977.50$1,587.00$2,297.70$9,197.70
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