Home Other Building Blocks 3-Chloro-1-propanol

3-Chloro-1-propanol

CAS No.:
627-30-5
Catalog Number:
AG0036XL
Molecular Formula:
C3H7ClO
Molecular Weight:
94.5401
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%(GC)
In Stock USA
United States
$33
- +
25g
98%(GC)
In Stock USA
United States
$57
- +
100g
98%(GC)
In Stock USA
United States
$94
- +
500g
98%(GC)
In Stock USA
United States
$316
- +
Product Description
Catalog Number:
AG0036XL
Chemical Name:
3-Chloro-1-propanol
CAS Number:
627-30-5
Molecular Formula:
C3H7ClO
Molecular Weight:
94.5401
MDL Number:
MFCD00002943
IUPAC Name:
3-chloropropan-1-ol
InChI:
InChI=1S/C3H7ClO/c4-2-1-3-5/h5H,1-3H2
InChI Key:
LAMUXTNQCICZQX-UHFFFAOYSA-N
SMILES:
OCCCCl
EC Number:
210-992-9
UNII:
148011U61G
NSC Number:
60190
UN Number:
2849
Properties
Complexity:
16.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
94.019g/mol
Formal Charge:
0
Heavy Atom Count:
5  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
94.538g/mol
Monoisotopic Mass:
94.019g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Literature
Title Journal
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Synthesis and anticancer activity of some new s-glycosyl and s-alkyl 1,2,4-triazinone derivatives. Molecules (Basel, Switzerland) 20110704
Electrochemical detection of low concentration chloropropanol using silver nanowire array electrodes in aqueous media. Journal of nanoscience and nanotechnology 20110301
Naturally occurring food toxins. Toxins 20100901
Improved synthesis of three methyl-branched pheromone components produced by the female lichen moth. Bioscience, biotechnology, and biochemistry 20100101
Characterization of the unimolecular water elimination reaction from 1-propanol, 3,3,3-propan-1-ol-d3, 3,3,3-trifluoropropan-1-ol, and 3-chloropropan-1-ol. The journal of physical chemistry. A 20090917
Analysis of vibrational spectra of 3-halo-1-propanols CH(2)XCH(2)CH(2)OH (X is Cl and Br). Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20081201
Design, synthesis, and antitumor activities of some novel substituted 1,2,3-benzotriazines. Molecules (Basel, Switzerland) 20080624
Experimental and computational investigation of gas-phase reaction of chlorine with n-propanol: observation of chloropropanol conformational isomerization at room temperature. The journal of physical chemistry. A 20080403
Intermolecular reactions of chlorohydrine anions: acetalization of carbonyl compounds under basic conditions. Organic letters 20060817
Survey of chloropropanols in soy sauces and related products. Food additives and contaminants 20031001
Stereocontrolled synthesis of cis-dibenzoquinolizine chlorofumarates: curare-like agents of ultrashort duration. The Journal of organic chemistry 20010518
Properties