Basic information
- Name:
Butanoic acid,4-chloro-
- CAS No.:
627-00-9
- Molecular Structure:
- Formula:
- C4H7ClO2
- Molecular Weight:
- 122.55
- Synonyms:
- Butyricacid, 4-chloro- (6CI,7CI,8CI);4-Chlorobutanoic acid;4-Chlorobutyric acid;NSC6391;NSC 76578;g-Chlorobutyricacid;
- EINECS:
- 210-977-7
- Density:
- 1.218 g/cm3
- Melting Point:
- 12-16 °C(lit.)
- Boiling Point:
- 310.6 °C at 760 mmHg
- Flash Point:
- 101.1 °C
- Hazard Symbols:
C- Risk Codes:
- 22-34
- Safety Description:
- 26-36/37/39-45 Details
Famous Chemical Enterprises
-
Livzon -
Total -
Shell -
Dupont -
Exxonmobil -
Akzonobel -
Basf -
Bayer -
BP
Please post your buying leads,so that our qualified suppliers will soon
contact you!
*Required Fields
Specification
The Butanoic acid,4-chloro- is an organic compound with the formula C4H7ClO2. The IUPAC name of this chemical is 4-chlorobutanoic acid. With the CAS registry number 627-00-9, it is also named as 4-Chloro-n-butyric Acid. The product's categories are omega-Chlorocarboxylic Acids; omega-Functional Alkanols, Carboxylic Acids, Amines & Halides; C1 to C5; Carbonyl Compounds; Carboxylic Acids.
Physical properties about Butanoic acid,4-chloro- are: (1)D/LogP: 0.70; (2)ACD/LogD (pH 5.5): -0.33; (3)ACD/LogD (pH 7.4): -2.13; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 5.38; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 26.3 Å2; (12)Index of Refraction: 1.449; (13)Molar Refractivity: 26.99 cm3; (14)Molar Volume: 100.5 cm3; (15)Polarizability: 10.7×10-24cm3; (16)Surface Tension: 39.1 dyne/cm; (17)Density: 1.218 g/cm3; (18)Flash Point: 101.1 °C; (19)Enthalpy of Vaporization: 60.65 kJ/mol; (20)Boiling Point: 310.6 °C at 760 mmHg; (21)Vapour Pressure: 0.000131 mmHg at 25°C.
Preparation of Butanoic acid,4-chloro-: this chemical can be prepared by dihydro-furan-2-one. This reaction will need reagent concentrated aqueous hydrochloric acid.
Uses of Butanoic acid,4-chloro-: it can be used to produce 4-chloro-butyryl chloride. It will need reagent thionyl chloride.
When you are using this chemical, please be cautious about it as the following:
It is harmful if swallowed. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. Besides, this chemical can cause burns. When you are using it, wear suitable gloves and eye/face protection. In case of accident or if you feel unwell seek medical advice immediately (show the label where possible).
You can still convert the following datas into molecular structure:
(1)SMILES: ClCCCC(=O)O
(2)InChI: InChI=1/C4H7ClO2/c5-3-1-2-4(6)7/h1-3H2,(H,6,7)
(3)InChIKey: IPLKGJHGWCVSOG-UHFFFAOYAC
(4)Std. InChI: InChI=1S/C4H7ClO2/c5-3-1-2-4(6)7/h1-3H2,(H,6,7)
(5)Std. InChIKey: IPLKGJHGWCVSOG-UHFFFAOYSA-N