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(3R)-3-amino-4-(2-bromophenyl)butanoic acid hydrochloride

(3R)-3-amino-4-(2-bromophenyl)butanoic acid hydrochloride

CAS: 401915-60-4

Formula: C10H13BrClNO2

SMILES: Cl.N[C@@H](CC(O)=O)CC1=CC=CC=C1Br

IUPAC: (3R)-3-amino-4-(2-bromophenyl)butanoic acid hydrochloride

InChI: InChI=1S/C10H12BrNO2.ClH/c11-9-4-2-1-3-7(9)5-8(12)6-10(13)14;/h1-4,8H,5-6,12H2,(H,13,14);1H/t8-;/m1./s1

Composition: C (40.77%), H (4.45%), Br (27.13%), Cl (12.03%), N (4.76%), O (10.86%)

Molar Mass: 294.57

Atom Count: 28

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 292.981819
Formal Charge 0
FSP3 0.3
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey CKWDUSDZVLBMMD-DDWIOCJRSA-N
Lipinski's Rule of Five 1
Molar Refractivity 57.36
Topological Polar Surface Area 63.32
Polarizability 22.56
Ring Count 1
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
99% <5 Days 401915-60-4 $204.28-$2,645.58$204.28$356.86$707.42$2,645.58
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