(S)-1-phenylpropane-1,3-diol

Name: (S)-1-phenylpropane-1,3-diol
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CAS No. 96854-34-1
Cat. No. CS-0470814
Molecule weight152.19
Purity≥98%
MDL No.MFCD00221510

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
Accessible (Haz class 3, 4, 5 or 8), International	$238.00+

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Structure of 96854-34-1

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General Information

CAS No. 96854-34-1
Cat. No. CS-0470814
Purity ≥98%
MDL No. MFCD00221510
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₉H₁₂O₂
Molecular Weight 152.19
Synonym(s) (S)-1-phenyl-1,3-propanediol
SMILES OCC[C@H](O)C1=CC=CC=C1

Synthesis

Route1
- In-stock
  
  33401-74-0
- ~88%
- 96854-34-1
References
- Kamal, Ahmed; Khanna; Ramu Tetrahedron Asymmetry, 2002 , vol. 13, # 18 p. 2039 - 2051
Route2
- 104672-27-7
- ~68%
- 96854-34-1
References
- Sann, Christine Le; Munoz, Dulce M.; Saunders, Natalie; Simpson, Thomas J.; Smith, David I.; Soulas, Florilene; Watts, Paul; Willis, Christine L. Organic and Biomolecular Chemistry, 2005 , vol. 3, # 9 p. 1719 - 1728
Route3
- 838841-85-3
- ~93%
- 96854-34-1
References
- Xu, Chengfu; Yuan, Chengye Tetrahedron, 2005 , vol. 61, # 8 p. 2169 - 2186

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H315-H319-H320
Precautionary Statements : P264-P280-P302+P352-P305+P351+P338-P362

Quality Control

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Computational Chemistry Data

TPSA 40.46
LogP 1.1024
H_Acceptors 2
H_Donors 2
Rotatable_Bonds 3

Other Classifications

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Building Blocks Skeleton Chiral compounds Chiral Building Blocks

Key Words

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(S)-1-phenylpropane-1,3-diol

CAS No. 96854-34-1

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