2-Formamido-4-methylpentanoic acid

HCID 100119
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Basic information

CAS
5338-45-4
Standard SMILES
CC(C)CC(NC=O)C(=O)O
InChIKey
HFBHOAHFRNLZGN-UHFFFAOYSA-N
Molecular formula
C7H13NO3
Average molar mass
159.18 g/mol

Names & identifiers

Preferred name
2-Formamido-4-methylpentanoic acid
IUPAC
2-formamido-4-methylpentanoic acid
English name
N-Formyl-DL-leucine
Molecular formula
C7H13NO3
Molecular weight
159.18

Names & synonyms

2-formamido-4-methylpentanoic acidDL-Leucine, N-formyl-N-Formyl-DL-leucineDTXSID90878997Formyl-dl-LeucinNSC334321N-Formyl-S-leucine;N-Formylleucine;NSC 334321SCHEMBL771044SCHEMBL771045SCHEMBL17496162-formamido-4-methylpentanoicacidNSC3162
Show more names
Leucine, N-formyl-
HFBHOAHFRNLZGN-UHFFFAOYSA-NNSC 3162NSC-3162MFCD00063283AKOS009158901LS-13324PD196187DB-053798

Database identifiers

CAS
5338-45-4、6113-61-7
PubChem CID
100119
DTXSID
DTXSID90878997

Properties

Computed structural properties

XLogP
0.9
Topological polar surface area
66.4 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
11

Physicochemical properties

Boiling point
360.6 · 360.6±25.0 °C(Predicted)
Density
1.093 · 1.093±0.06 g/cm3(Predicted)
pka
3.51 · 3.51±0.21(Predicted)

Chemistry & industry

Upstream & downstream products

Suppliers3 total

阳谷荣科商贸有限公司15863541132 · [email protected]
菏泽星达医药科技有限公司13583079096 · [email protected]
山东煜昌药业有限公司531-87153728 13805401165 · [email protected]

Related reactions

2 records
New reaction record

Compound notes

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