(S)-1-(3-Nitrophenyl)propan-1-ol

Base Information

Chemical Name:(S)-1-(3-Nitrophenyl)propan-1-ol
CAS No.:188770-83-4
Molecular Formula:C9H11NO3
Molecular Weight:181.19
Hs Code.:
DSSTox Substance ID:DTXSID30444655
Nikkaji Number:J900.329K
Wikidata:Q72495729
Mol file:188770-83-4.mol

Synonyms:(S)-1-(3-Nitrophenyl)propan-1-ol;188770-83-4;(S)-1-(3-Nitrophenyl)propanol;(1S)-1-(3-nitrophenyl)propan-1-ol;(S)-(-)-1-(3-Nitrophenyl)propanol;SCHEMBL6898173;DTXSID30444655;LSEJDXFJBNGGBI-VIFPVBQESA-N;MFCD08064293;(S)-1-(3-Nitrophenyl)-1-propanol;AKOS016843000;EN300-119323;A805420;Z1127664358

Suppliers and Price of (S)-1-(3-Nitrophenyl)propan-1-ol

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
(1S)-1-(3-nitrophenyl)propan-1-ol
100mg
$ 285.00

Crysdot
(S)-1-(3-Nitrophenyl)propan-1-ol 95+%
1g
$ 299.00

Chemenu
(S)-1-(3-nitrophenyl)propan-1-ol 95%
1g
$ 282.00

Alichem
(S)-1-(3-Nitrophenyl)propan-1-ol
1g
$ 400.00

AK Scientific
(S)-1-(3-Nitrophenyl)propan-1-ol
5g
$ 2889.00

AK Scientific
(S)-1-(3-Nitrophenyl)propan-1-ol
1g
$ 1081.00

Total 10 raw suppliers

Chemical Property of (S)-1-(3-Nitrophenyl)propan-1-ol

Chemical Property:

Vapor Pressure:0.001mmHg at 25°C
Refractive Index:1.565
Boiling Point:295.307 °C at 760 mmHg
PKA:13.89±0.20(Predicted)
Flash Point:127.842 °C
PSA：66.05000
Density:1.217 g/cm³
LogP:2.56140
Storage Temp.:2-8°C
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:181.07389321
Heavy Atom Count:13
Complexity:178

Purity/Quality:

99.3% ^*data from raw suppliers

(1S)-1-(3-nitrophenyl)propan-1-ol ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC(C1=CC(=CC=C1)[N+](=O)[O-])O
Isomeric SMILES:CC[C@@H](C1=CC(=CC=C1)[N+](=O)[O-])O

Technology Process of (S)-1-(3-Nitrophenyl)propan-1-ol

There total 4 articles about (S)-1-(3-Nitrophenyl)propan-1-ol which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 88.0%

: 557-20-0
diethylzinc

: 99-61-6
3-nitro-benzaldehyde

: 188770-83-4
(S)-1-(3-nitrophenyl)propan-1-ol

Guidance literature:: chiral polymer-supported Ti-complex of substituted R-BINOL; In dichloromethane; at 0 ℃; for 54h;
DOI:10.1016/S0040-4020(00)00260-X

Reference yield: 10.7%

: 108-22-5
Isopropenyl acetate

: 29067-53-6
α-ethyl-3-nitrobenzyl alcohol

: 188770-83-4
(S)-1-(3-nitrophenyl)propan-1-ol

: (R)-1-(3-nitrophenyl)propanol acetate

Guidance literature:: With tert-butyl methyl ether; Amano P₃₀; at 20 - 25 ℃; for 48h;
DOI:10.1021/jo9809229

Reference yield:

: 557-20-0
diethylzinc

: 99-61-6
3-nitro-benzaldehyde

: (R)-1-(3-nitrophenyl)propan-1-ol

: 188770-83-4
(S)-1-(3-nitrophenyl)propan-1-ol

Guidance literature:: With (S)-2,2'-dihydroxy-1,1'-binaphthyl; titanium(IV) isopropylate; In hexane; dichloromethane; at 0 ℃; for 5h; Yield given. Yields of byproduct given. Title compound not separated from byproducts;
DOI:10.1016/S0957-4166(97)00024-4