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ChemicalBook >> CAS DataBase List >>1-Bromo-4-chlorobutane

1-Bromo-4-chlorobutane

CAS No.
6940-78-9
Chemical Name:
1-Bromo-4-chlorobutane
Synonyms
4-BROMOBUTYL CHLORIDE;4-CHLOROBUTYL BROMIDE;4-Bromo-1-chlorobutane;NAPRO-008;1-Bromo-4-chL;1-Brom-4-chlorbutan;1-Bromo-4-chloroutane;1-Chloro-4-bromobutane;1-bromo-4-chloro-butan;4-CHLORO-1-BROMOBUTANE
CBNumber:
CB0753483
Molecular Formula:
C4H8BrCl
Molecular Weight:
171.46
MDL Number:
MFCD00001010
MOL File:
6940-78-9.mol
MSDS File:
SDS
Last updated:2026-05-27 22:53:31
Product description Number Pack Size Price
1-Bromo-4-chlorobutane 99% B60800 25g $49.4
1-Bromo-4-chlorobutane 99% B60800 100g $164
1-Bromo-4-chlorobutane >99.0%(GC) B1345 25g $36
1-Bromo-4-chlorobutane >99.0%(GC) B1345 500g $227
1-Bromo-4-chlorobutane TRC-B682650-1G 1g $92
More product size

1-Bromo-4-chlorobutane Properties

Melting point 96-97 °C(Solv: hexane (110-54-3); ethyl acetate (141-78-6))
Boiling point 80-82 °C/30 mmHg (lit.)
Density 1.488 g/mL at 25 °C (lit.)
refractive index n20/D 1.4875(lit.)
Flash point 140 °F
storage temp. Store below +30°C.
solubility soluble in Chloroform
form Liquid
color Clear
Water Solubility SLIGHTLY SOLUBLE
BRN 1098275
InChI 1S/C4H8BrCl/c5-3-1-2-4-6/h1-4H2
InChIKey NIDSRGCVYOEDFW-UHFFFAOYSA-N
SMILES ClCCCCBr
CAS DataBase Reference 6940-78-9(CAS DataBase Reference)
FDA UNII 3WY7Z6MQN8
NIST Chemistry Reference Butane, 1-bromo-4-chloro-(6940-78-9)
EPA Substance Registry System Butane, 1-bromo-4-chloro- (6940-78-9)
UNSPSC Code 12352101
NACRES NA.22

SAFETY

Risk and Safety Statements

Symbol(GHS)  Flame (GHS02)Exclamation Mark (GHS07)
GHS02,GHS07
Signal word  Warning
Hazard statements  H226-H302
Precautionary statements  P210-P233-P240-P241-P242-P301+P312
PPE Eyeshields, Gloves, multi-purpose combination respirator cartridge (US)
Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  23-24/25-37/39-26
RIDADR  UN 1993 3/PG 3
WGK Germany  3
TSCA  TSCA listed
HazardClass  3
PackingGroup  III
HS Code  29034980
Storage Class 3 - Flammable liquids
Hazard Classifications Acute Tox. 4 Oral
Flam. Liq. 3
REACH Registrations Active
Limited Quantities 5.0 L (1.3 gallons) (liquid)
Excepted Quantities Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
NFPA 704
2
2 0

1-Bromo-4-chlorobutane price More Price(35)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Sigma-Aldrich B60800 1-Bromo-4-chlorobutane 99% 6940-78-9 25g $49.4 2026-04-30 Buy
Sigma-Aldrich B60800 1-Bromo-4-chlorobutane 99% 6940-78-9 100g $164 2026-04-30 Buy
TCI Chemical B1345 1-Bromo-4-chlorobutane >99.0%(GC) 6940-78-9 25g $36 2026-04-30 Buy
TCI Chemical B1345 1-Bromo-4-chlorobutane >99.0%(GC) 6940-78-9 500g $227 2026-04-30 Buy
TRC TRC-B682650-1G 1-Bromo-4-chlorobutane 6940-78-9 1g $92 2026-06-03 Buy
Product number Packaging Price Buy
B60800 25g $49.4 Buy
B60800 100g $164 Buy
B1345 25g $36 Buy
B1345 500g $227 Buy
TRC-B682650-1G 1g $92 Buy

1-Bromo-4-chlorobutane Chemical Properties,Uses,Production

Chemical Properties

clear liquid

Uses

1-Bromo-4-chlorobutane is used as a reagent in the synthesis of a novel spirohydantoin derivative as a potent multireceptor-active antipsychotic and antidepressant agent.

Synthesis

Benzyloxyacetic acid

30379-55-6

1-Bromo-3-chloropropane

109-70-6

1-Bromo-4-chlorobutane

6940-78-9

1. n-Butyllithium (1.6 M hexane solution, 5.0 mL, 8.0 mmol) was added slowly and dropwise to a tetrahydrofuran (THF, 10 mL) solution of diisopropylamine (1.1 mL, 8.0 mmol) at -30 °C and stirred continuously for 30 min at this temperature. 2. the reaction system was cooled down to -70 °C, a solution of (benzyloxy)acetic acid (0.60 g, 3.6 mmol) in THF (5 mL) was added slowly dropwise and stirred for 30 min at the same temperature. 3. Maintaining the -70 °C condition, 1-bromo-3-chloropropane (3.6 mL, 36 mmol) was added to the reaction mixture and stirring was continued for 30 minutes before the reaction system was slowly warmed to room temperature and stirred for 2 hours. 4. The reaction mixture was poured into ice-cold water and washed with ethyl acetate. 5. The pH of the aqueous layer was adjusted to 3-4 with 6 M hydrochloric acid and the mixture was subsequently extracted with ethyl acetate. 6. The organic layers were combined, washed with saturated brine, dried over anhydrous magnesium sulfate and concentrated under reduced pressure to remove the solvent. 7. The crude product was purified by silica gel column chromatography (eluent: hexane/ethyl acetate = 100/0 to 50/50 gradient elution) to afford 1-bromo-4-chlorobutane as a colorless oil (0.28 g, 32% yield). 8. The structure of the product was investigated by 1H NPD analysis. 8. The structure of the product was confirmed by 1H NMR (CDCl3): δ 1.91-2.06 (4H, m), 3.54 (2H, t, J=5.1 Hz), 4.08 (1H, t, J=6.6 Hz), 4.55 and 4.74 (2H, d, J=11.4 Hz), 7.34-7.39 (5H, m).

References

[1] Patent: EP2455380, 2012, A1. Location in patent: Page/Page column 79

30379-55-6
109-70-6
6940-78-9
Synthesis of 1-Bromo-4-chlorobutane from Benzyloxyacetic acid and 1-Bromo-3-chloropropane
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1-Bromo-4-chlorobutane pictures 2026-06-08 1-Bromo-4-chlorobutane
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