1-Bromopentane Structure

1-Bromopentane

Chemical Properties

Melting point −95 °C(lit.)
Boiling point 130 °C(lit.)
Density  1.218 g/mL at 25 °C(lit.)
vapor density  >1 (vs air)
refractive index  n20/D 1.444(lit.)
Flash point 88 °F
storage temp.  Flammables area
solubility  H2O: insoluble
form  Liquid
color  Clear colorless to light yellow
Water Solubility  practically insoluble
Thermal Conductivity 0.105 W/(m·K) at 25 ℃
Merck  14,602
BRN  1730981
Henry's Law Constant 5.0×10-4 mol/(m3Pa) at 25℃, Duchowicz et al. (2020)
Dielectric constant 6.3(10℃)
Stability Stable. Flammable. Incompatible with strong oxidizing agents, strong bases.
InChI 1S/C5H11Br/c1-2-3-4-5-6/h2-5H2,1H3
InChIKey YZWKKMVJZFACSU-UHFFFAOYSA-N
SMILES CCCCCBr
CAS DataBase Reference 110-53-2(CAS DataBase Reference)
FDA UNII Z2S4R599P0
NIST Chemistry Reference Pentane, 1-bromo-(110-53-2)
EPA Substance Registry System Pentane, 1-bromo- (110-53-2)
UNSPSC Code 12352100
NACRES NA.22

Safety

Symbol(GHS) Flame (GHS02)Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H315-H319-H226
Precautionary statements P501-P240-P210-P233-P243-P241-P242-P264-P280-P370+P378-P337+P313-P305+P351+P338-P362+P364-P303+P361+P353-P332+P313-P403+P235
Hazard Codes  Xi,F,N,Xn
Risk Statements  10-36/37/38-51/53-22
Safety Statements  26-36-61-37/39-29-16
RIDADR  UN 1993 3/PG 3
WGK Germany  2
RTECS  RZ9770000
Hazard Note  Irritant/Flammable
TSCA  TSCA listed
HazardClass  3
PackingGroup  III
HS Code  29033036
Storage Class 3 - Flammable liquids
Hazard Classifications Aquatic Chronic 2
Flam. Liq. 3
Skin Irrit. 2
Toxicity LD50 ipr-mus: 1250 mg/kg GTPZAB 20(12),52,76
NFPA 704:
3
0

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