2-Bromo-3-methylpentanoic acid

HCID 260481
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Basic information

CAS
42880-22-8
Standard SMILES
CCC(C)C(Br)C(=O)O
InChIKey
GQZXYZIKUQUVKE-UHFFFAOYSA-N
Molecular formula
C6H11BrO2
Average molar mass
195.05 g/mol
Monoisotopic mass
193.99424

Names & identifiers

Preferred name
2-Bromo-3-methylpentanoic acid
IUPAC
2-bromo-3-methylpentanoic acid
English name
2-Bromo-3-methylvalericacid
Molecular formula
C6H11BrO2
Molecular weight
195.05434

Names & synonyms

2-bromo-3-methylpentanoic acid42880-22-8DTXSID10293729RefChem:1062450DTXCID80244869(2S)-2-Bromo-3-methylpentanoic acid2-BROMO-3-METHYLVALERIC ACID1432257-43-6NSC91786NCIOpen2_0012962-bromo-3-methylpentanoicacid2-bromo-3-methyl-valeric acid
Show more names
2-Bromo-3-methylvalericacidPentanoic acid, 2-bromo-3-methyl-
SCHEMBL63797562-bromo-3-methyl-pentanoic acidGQZXYZIKUQUVKE-UHFFFAOYSA-Nalpha-bromo-3-methylpentanoic acidNSC-91786AKOS005266581SB45500SB46788

Database identifiers

CAS
42880-22-8
PubChem CID
260481
DTXSID
DTXSID10293729
Nikkaji
J441.017C

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
37.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
9

Physicochemical properties

storage temp.
2 · 2-8°C
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338

Safety & regulation

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Upstream & downstream products

Downstream products

Suppliers9 total

宁波季诺化学品有限公司0574-87314919 057487319282 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
赛纳斯特化学（欢迎点击联系）021-60343070
雷丁试剂0510-85629785 18013409632 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]

Related reactions

4 records
New reaction record

Compound notes

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