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Pharmaceutical Intermediates
N-METHYL-(TETRAHYDROFURAN-3-YLMETHYL)AMINE
CAS:
7179-93-3
MW:
115.17
MF:
C6H13NO
 
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Names and ldentifier
Properties
Computational chemical data
Realated Product Infomation
1. Names and Identifiers
1.1 Name
N-METHYL-(TETRAHYDROFURAN-3-YLMETHYL)AMINE
1.2 Synonyms
3-Furanmethanamine, tetrahydro-N-methyl-; methyl[(oxolan-3-yl)methyl]amine; N-methyl(tetrahydrofuran-3-yl)methanamine; N-Methyl-1-(tetrahydro-3-furanyl)methanamine; N-methyl-1-(tetrahydrofuran-3-yl)methanamine; N-Methyl-1-(tetrahydrofuran-3-yl)methylamine; N-methyl-tetrahydrofuran-3-methylamine;
1.3 CAS No.
7179-93-3
1.4 CID
16228714
1.5 Molecular Formula
C6H13NO
1.6 Inchi
InChI=1S/C6H13NO/c1-7-4-6-2-3-8-5-6/h6-7H,2-5H2,1H3
1.7 InChkey
ZUGRRINNTXSWBR-UHFFFAOYSA-N
1.8 Canonical Smiles
CNCC1CCOC1
1.9 Isomers Smiles
CNCC1CCOC1
2. Properties
2.1 pKa
10.22±0.10(Predicted)
3. Computed Properties
Molecular Weight:
115.17g/mol
Molecular Formula:
C
6
H
13
NO
Compound Is Canonicalized:
True
Exact Mass:
0
XLogP3-AA:
115.099714038
Monoisotopic Mass:
115.099714038
Complexity:
65.5
Rotatable Bond Count:
2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Topological Polar Surface Area:
21.3
Heavy Atom Count::
8
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Isotope Atom Count:
0
Covalently-Bonded Unit Count:
1
CACTVS Substructure Key Fingerprint:
AAADccBiIAAAAAAAAAAAAAAAAAAAASAAAAAAAAAAAAAAAAAAAAAAHgAQAAAADQDhgAYCAALABAAAAAAAAAAAAAAAAAAAAIAIAAAAAAAAgAAGAAAGEAAAAAAgAAAIAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==
4. Toltal 4 Suppliers
View more
Zhejiang Kaili Industrial Co., Ltd.
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Update Time:
2019/04/01
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Nanjing Chemlin Chemical Co., Ltd.
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Update Time:
2024/03/04
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Pure Chemistry Scientific Inc.
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Update Time:
2019/02/25
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Syntechem Co.,Ltd
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Update Time:
2019/02/22
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5. Realated Product Infomation
(TETRAHYDROFURAN-2-YLMETHYL)(3-THIENYLMETHYL)AMINE
cas:892592-66-4
tetrahydrofuran-2-amine
cas:127662-20-8
(S)-TETRAHYDROFURAN-3-AMINE HYDROCHLORIDE
cas:204512-95-8
(R)-Tetrahydrofuran-3-amine hydrochloride
cas:1072015-52-1
3-[(TETRAHYDROFURAN-2-YLMETHYL)AMINO]PROPANENITRILE
cas:90322-18-2
(4-ISOPROPYL-BENZYL)(TETRAHYDROFURAN-2-YL-METHYL)AMINE
cas:436096-82-1
1. Names and Identifiers
1.1 Name
1.2 Synonyms
1.3 CAS No.
1.4 Molecular Formula
1.5 Inchi
1.6 InChkey
1.7 Canonical Smiles
1.8 Isomers Smiles
2. Properties
2.1 pKa
3.
Computational chemical data
4.
Toltal 4 Suppliers
5.
Realated Product Infomation
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