CAS
94134-96-0 Purity
96%
94134-96-0 Purity
96%
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4-Methylpentyl 2-methylcrotonate
CAS
94135-07-6
Catalog Number
ACM94135076
Category
Other Products
Molecular Weight
184.275300 [g/mol]
Molecular Formula
C11H20O2
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Specification
Synonyms
4-Methylpentyl 2-methylcrotonate, EINECS 302-875-7, CID6366455, 94135-07-6
IUPAC Name
4-methylpentyl (E)-2-methylbut-2-enoate
Canonical SMILES
CC=C(C)C(=O)OCCCC(C)C
InChI Key
IGQMPEJHZCJCHT-BJMVGYQFSA-N
Boiling Point
229.5ºC at 760mmHg
Flash Point
84.6ºC
Density
0.888g/cm³
EC Number
302-875-7
Exact Mass
184.14600
H-Bond Acceptor
2
H-Bond Donor
0
What is the molecular formula of 4-Methylpentyl 2-methylcrotonate?
The molecular formula of 4-Methylpentyl 2-methylcrotonate is C11H20O2.
What is the molecular weight of 4-Methylpentyl 2-methylcrotonate?
The molecular weight of 4-Methylpentyl 2-methylcrotonate is 184.27 g/mol.
What is the IUPAC name of 4-Methylpentyl 2-methylcrotonate?
The IUPAC name of 4-Methylpentyl 2-methylcrotonate is 4-methylpentyl (E)-2-methylbut-2-enoate.
What is the InChI of 4-Methylpentyl 2-methylcrotonate?
The InChI of 4-Methylpentyl 2-methylcrotonate is InChI=1S/C11H20O2/c1-5-10(4)11(12)13-8-6-7-9(2)3/h5,9H,6-8H2,1-4H3/b10-5+.
What is the InChIKey of 4-Methylpentyl 2-methylcrotonate?
The InChIKey of 4-Methylpentyl 2-methylcrotonate is IGQMPEJHZCJCHT-BJMVGYQFSA-N.
What is the canonical SMILES of 4-Methylpentyl 2-methylcrotonate?
The canonical SMILES of 4-Methylpentyl 2-methylcrotonate is CC=C(C)C(=O)OCCCC(C)C.
What is the isomeric SMILES of 4-Methylpentyl 2-methylcrotonate?
The isomeric SMILES of 4-Methylpentyl 2-methylcrotonate is C/C=C(\C)/C(=O)OCCCC(C)C.
What is the CAS number of 4-Methylpentyl 2-methylcrotonate?
The CAS number of 4-Methylpentyl 2-methylcrotonate is 94135-07-6.
What is the European Community (EC) number of 4-Methylpentyl 2-methylcrotonate?
The European Community (EC) number of 4-Methylpentyl 2-methylcrotonate is 302-875-7.
What is the XLogP3-AA value of 4-Methylpentyl 2-methylcrotonate?
The XLogP3-AA value of 4-Methylpentyl 2-methylcrotonate is 3.4.
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