Heptanoic acid, 7-bromo-, ethyl ester
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Heptanoic acid, 7-bromo-, ethyl ester
structure -
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CAS No:
29823-18-5
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Formula:
C9H17BrO2
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Chemical Name:
Heptanoic acid, 7-bromo-, ethyl ester
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Synonyms:
Heptanoic acid,7-bromo-,ethyl ester;Ethyl 7-bromoheptanoate;7-Bromoheptanoic acid ethyl ester
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CAS No:
Heptanoic acid, 7-bromo-, ethyl ester Basic Attributes
237.13
237.13
249-883-6
M5QR4GAP1S
DTXSID80183961
2915900090
Characteristics
26.3
2.8
light yellow liquid
1.2±0.1 g/cm3
29 °C(lit.)
112 °C @ Press: 5 Torr
>230 °F
1.462
0.0241mmHg at 25°C
Safety Information
IRRITANT
NONH for all modes of transport
3
36/37/38
26-36
Xi
P305 + P351 + P338
H315-H319-H335
|Warning|H315 (97.73%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 44 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:237.13
XLogP3:2.8
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:8
Exact Mass:236.04119
Monoisotopic Mass:236.04119
Topological Polar Surface Area:26.3
Heavy Atom Count:12
Complexity:115
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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Heptanoic acid, 7-bromo-, ethyl ester
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